Compile Data Set for Download or QSAR

Found 95 hits with all data for this entryid

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
BDBM11	BDBM36077	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-5.21	1.64	-6.85	3.83	4.80	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36106	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-5.19	-0.313	-4.87	3.81	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36107	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-5.19	-0.335	-4.85	3.80	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36077	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-5.11	1.72	-6.83	3.75	4.80	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36055	CHEBI KEGG MMDB PC cid PC sid PDB	KEGG PC cid PC sid		-4.87	2.31	-7.19	3.58	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36056	CHEBI KEGG MMDB PC cid PC sid PDB	KEGG PC cid PC sid		-4.85	2.22	-7.07	3.56	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36065	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-4.66	1.82	-6.47	3.42	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36065	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-4.62	1.84	-6.45	3.39	4.80	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36066	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-4.62	1.89	-6.50	3.39	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36085	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-4.61	0.0498	-4.66	3.37	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36066	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-4.59	1.89	-6.47	3.37	4.80	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36086	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-4.59	0.192	-4.78	3.36	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36114	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-4.23	-3.05	-1.18	3.10	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.88	-2.36	-1.50	2.85	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36051	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.84	-0.548	-3.30	2.82	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36083	CHEBI KEGG MMDB PC cid PC sid PDB	KEGG PC cid PC sid		-3.83	-2.49	-1.34	2.81	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36084	CHEBI KEGG MMDB PC cid PC sid PDB	KEGG PC cid PC sid		-3.79	-2.51	-1.28	2.78	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36052	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.77	-0.712	-3.06	2.76	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36067	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid		-3.75	1.21	-4.94	2.75	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36068	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid		-3.67	1.00	-4.66	2.69	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36099	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.59	-1.52	-2.07	2.63	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36117	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.57	-1.50	-2.05	2.62	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36116	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-3.55	-1.08	-2.48	2.61	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36098	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.55	-1.49	-2.06	2.60	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36049	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.53	-1.22	-2.32	2.59	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36050	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.50	-1.15	-2.34	2.56	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36073	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.43	-1.55	-1.87	2.52	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36074	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.43	-1.55	-1.88	2.52	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36053	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.39	-0.762	-2.63	2.49	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36054	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.35	-0.812	-2.53	2.45	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36060	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.32	-0.356	-2.96	2.43	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36059	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.30	-0.427	-2.88	2.42	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36110	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.27	-1.21	-2.08	2.34	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36041	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.23	-1.03	-2.20	2.37	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36042	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.22	-1.00	-2.22	2.36	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36062	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.16	1.08	-4.23	2.32	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36115	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.10	-1.04	-2.06	2.27	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36061	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.07	1.21	-4.25	2.25	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36091	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-3.06	1.13	-4.18	2.24	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36026	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid		-3.01	-1.36	-1.65	2.21	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36112	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid		-2.99	-0.456	-2.53	2.20	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36069	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-2.96	-0.833	-2.13	2.17	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36070	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-2.95	-0.577	-2.39	2.17	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36057	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-2.94	-0.712	-2.22	2.15	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36092	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-2.93	0.983	-3.91	2.15	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36058	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-2.93	-0.527	-2.41	2.15	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36038	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid		-2.88	1.21	-4.08	2.11	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36037	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid		-2.86	1.13	-3.99	2.10	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36043	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-2.82	-1.02	-1.81	2.07	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM36109	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid PDB		-2.82	2.03	-4.85	2.07	4.80	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)

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