Compile Data Set for Download or QSAR

Found 52 hits with all data for this entryid

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kJ/mole	-TΔS° kJ/mole	ΔH° kJ/mole	log K	pH	Temp °C
BDBM36271	BDBM36265	PC cid PC sid	CHEBI KEGG PC cid PC sid		-29.3	-10.3	-18.9	5.13	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM36265	PC cid PC sid	CHEBI KEGG PC cid PC sid		-28.7	-11.8	-16.9	5.03	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM36266	PC cid PC sid	CHEBI KEGG PC cid PC sid		-28.4	-6.26	-22.1	4.97	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36272	BDBM36266	PC cid PC sid	CHEBI KEGG PC cid PC sid		-28.3	-5.90	-22.4	4.96	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36271	BDBM36266	PC cid PC sid	CHEBI KEGG PC cid PC sid		-28.3	-5.72	-22.5	4.95	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM36265	PC cid PC sid	CHEBI KEGG PC cid PC sid		-28.2	-4.23	-24.0	4.94	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36272	BDBM36265	PC cid PC sid	CHEBI KEGG PC cid PC sid		-28.1	-3.85	-24.3	4.92	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36271	BDBM36263	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-26.8	-15.9	-10.9	4.70	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM36266	PC cid PC sid	CHEBI KEGG PC cid PC sid		-26.8	-3.76	-23	4.70	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM36266	PC cid PC sid	CHEBI KEGG PC cid PC sid		-26.6	-4.03	-22.6	4.66	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM36265	PC cid PC sid	CHEBI KEGG PC cid PC sid		-26.3	-6.11	-20.2	4.61	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36267	BDBM36265	PC cid PC sid	CHEBI KEGG PC cid PC sid		-26.0	-6.62	-19.3	4.55	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM36263	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-25.9	-15.4	-10.4	4.53	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36267	BDBM36266	PC cid PC sid	CHEBI KEGG PC cid PC sid		-25.7	-6.77	-19.0	4.51	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM36263	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-24.9	-11.1	-13.8	4.36	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM11	BDBM36266	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid		-24.5	-1.34	-23.2	4.30	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM11	BDBM36265	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid		-24.4	-3.52	-20.9	4.27	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36272	BDBM36263	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-24.4	-10.9	-13.5	4.27	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM36194	PC cid PC sid	PC cid PC sid		-24.0	-10.9	-13.1	4.21	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36271	BDBM36194	PC cid PC sid	PC cid PC sid		-24.0	-10.4	-13.6	4.20	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36272	BDBM36264	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid		-23.8	-7.87	-15.9	4.16	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36267	BDBM36263	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-23.6	-11.0	-12.6	4.14	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36271	BDBM36264	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid		-23.4	-9.21	-14.2	4.09	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM36263	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-23.4	-10.2	-13.2	4.09	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM36264	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid		-23.2	-10.8	-12.4	4.06	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM36264	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid		-23.0	-7.54	-15.4	4.03	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM36194	PC cid PC sid	PC cid PC sid		-22.8	-9.72	-13.1	4.00	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM36264	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid		-22.5	-4.53	-18.0	3.94	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM11	BDBM36263	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-22.4	-8.53	-13.8	3.92	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36271	BDBM36178	PC cid PC sid	PC cid PC sid		-22.3	-11.7	-10.6	3.90	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM36178	PC cid PC sid	PC cid PC sid		-22.1	-12.8	-9.29	3.87	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36267	BDBM36194	PC cid PC sid	PC cid PC sid		-21.9	-8.32	-13.5	3.83	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM36194	PC cid PC sid	PC cid PC sid		-21.9	-11.1	-10.7	3.83	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36267	BDBM36264	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid		-21.5	-7.25	-14.2	3.76	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM36178	PC cid PC sid	PC cid PC sid		-21.1	-11.2	-9.92	3.70	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM11	BDBM36264	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid		-21.1	2.74	-23.8	3.70	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM11	BDBM36194	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-20.8	-5.10	-15.7	3.65	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36267	BDBM36178	PC cid PC sid	PC cid PC sid		-20.3	-9.84	-10.4	3.55	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM36178	PC cid PC sid	PC cid PC sid		-20.2	-12.7	-7.52	3.54	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM11	BDBM36178	CHEBI KEGG MMDB PC cid PC sid PDB	PC cid PC sid		-19.2	-7.63	-11.6	3.37	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-18.4	-14.9	-3.44	3.21	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-18.1	-14.6	-3.44	3.16	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36271	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-17.7	-11.9	-5.82	3.10	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-17.1	-15.1	-2.01	2.98	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36267	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-16.7	-10.6	-6.08	2.92	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM36176	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-16.4	-15.3	-1.04	2.92	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-16.3	-10.2	-6.08	2.85	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36271	BDBM36176	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-15.9	-14.0	-1.93	2.80	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM36176	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-15.9	-15.8	-0.150	2.79	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM36176	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-14.8	-12.9	-2	2.56	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)

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