GPCRdb

CP-96345

Agent/drug
Bioactivity

CP-96345

SMILES	COc1ccccc1CN[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1
InChIKey	FLNYLINBEZROPL-NSOVKSMOSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	1
Rotatable bonds	7
Molecular weight (Da)	412.3

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

M₅	ACM5	Human	Acetylcholine (muscarinic)	A	pKi	5.31	5.31	5.31	ChEMBL
NK₁	NK1R	Human	Tachykinin	A	pKi	8.51	9.11	9.52	ChEMBL
NK₁	NK1R	Human	Tachykinin	A	pKd	7.78	8.56	9.50	ChEMBL
NK₂	NK2R	Rabbit	Tachykinin	A	pKd	4.30	4.30	4.30	ChEMBL
NK₃	NK3R	Rat	Tachykinin	A	pKd	5.60	5.60	5.60	ChEMBL

Showing 1 to 5 of 5 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

GPR65	PSYR	Human	A orphans	A	pIC50	5.95	5.95	5.95	ChEMBL
NK₁	NK1R	Mouse	Tachykinin	A	pIC50	7.62	7.62	7.62	ChEMBL
NK₁	NK1R	Guinea pig	Tachykinin	A	pIC50	9.25	9.32	9.40	ChEMBL
NK₁	NK1R	Rat	Tachykinin	A	pIC50	7.50	7.50	7.50	ChEMBL
NK₁	NK1R	Human	Tachykinin	A	pIC50	4.09	8.78	9.70	ChEMBL

Showing 1 to 5 of 5 entries

CP-96345

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Clinical Trials

Phase I 0

Phase II 0

Phase III 0

Approved No

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.