Compile Data Set for Download or QSAR

Found 28 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
BDBM4	BDBM36163	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.94	1.28	-5.25	2.88	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36164	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.92	1.35	-5.28	2.88	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36160	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.49	0.427	-3.92	2.56	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36162	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.46	0.570	-4.04	2.54	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36160	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-3.46	0.641	-4.11	2.54	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36158	MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid		-2.87	0.762	-3.63	2.10	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36159	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid PDB		-2.87	0.812	-3.68	2.10	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36160	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid		-2.82	-3.28	0.454	2.07	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36152	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid PDB		-2.77	0.0712	-2.84	2.03	10.0	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36173	MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG PC cid PC sid PDB		-2.60	0.214	-2.77	1.90	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36159	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid PDB		-2.08	-2.99	0.884	1.52	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36158	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid		-2.05	-3.06	0.979	1.51	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36157	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid PDB		-1.96	0.406	-2.36	1.44	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36156	MMDB PC cid PC sid PDB	CHEBI DrugBank PC cid PC sid		-1.89	0.741	-2.63	1.39	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36155	MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-1.89	0.783	-2.65	1.38	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36152	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid PDB		-1.84	0.313	-2.15	1.34	5.01	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36155	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-1.77	-2.56	0.764	1.30	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36152	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid PDB		-1.72	2.63	-4.35	1.27	10.0	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36173	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG PC cid PC sid PDB		-1.65	-2.67	1.03	1.20	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36156	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank PC cid PC sid		-1.53	-2.71	1.17	1.11	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36157	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI PC cid PC sid PDB		-1.53	-2.71	1.17	1.11	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36152	MMDB PC cid PC sid PDB	CHEBI PC cid PC sid PDB		-1.48	1.92	-3.42	1.08	5.01	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36154	MMDB PC cid PC sid PDB	CHEBI KEGG MMDB PC cid PC sid		-1.34	-1.07	-0.287	0.987	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM36161	MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-1.24	2.35	-3.58	0.903	5.01	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM4	BDBM18073	MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-1.24	1.64	-2.87	0.903	5.01	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36153	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-0.884	-2.35	1.43	0.653	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM18073	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-0.717	2.14	-2.87	0.477	5.01	25
NIST					J Phys Chem 98: 10282-10288 (1994)
BDBM11	BDBM36154	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG MMDB PC cid PC sid		-0.573	-3.20	2.65	0.415	6.90	25
NIST					J Phys Chem 98: 10282-10288 (1994)

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