BDBM9 1-hexanol::1-hexyl alcohol::hexan-1-ol::n-hexanol

SMILES: CCCCCCO

InChI Key: InChIKey=ZSIAUFGUXNUGDI-UHFFFAOYSA-N

Data: 6 ITC

PDB links: 3 PDB IDs match this monomer. 4582 PDB IDs contain this monomer as substructures. 4582 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- ITC Data from BindingDB

Found 6 hits for monomerid = 9

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	BDBM9	CHEBI MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-3.99	0.211	-4.20	2.96	6.90	21.2
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM9	CHEBI MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-4.01	0.427	-4.42	2.94	6.90	25
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM9	CHEBI MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-3.94	1.01	-4.97	2.84	6.90	30.1
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM9	CHEBI MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-3.89	1.77	-5.68	2.77	6.90	35.2
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM9	CHEBI MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-3.99	0.192	-4.18	2.92	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM4	BDBM9	CHEBI MMDB PC cid PC sid PDB	CHEBI MMDB PC cid PC sid PDB		-4.02	0.142	-4.16	2.95	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)