GPCRdb

NCGC 84

Agent/drug
Bioactivity

NCGC 84

SMILES	Cc1c(P(=S)(c2ccccc2)c2ccccc2)[n+]2ccccc2n1C/C=C/c1ccccc1
InChIKey	VSWYSDPXUHVQCG-DTQAZKPQSA-N

Chemical Properties

Hydrogen bond acceptors	2
Hydrogen bond donors	0
Rotatable bonds	6
Molecular weight (Da)	465.2

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids ChEMBL_compound_ids GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_2A	ADA2A	Human	Adrenoceptors	A	pKi	6.25	6.25	6.25	ChEMBL
α_2C	ADA2C	Human	Adrenoceptors	A	pKi	6.65	6.65	6.65	ChEMBL
β₃	ADRB3	Human	Adrenoceptors	A	pKi	5.69	5.69	5.69	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	6.93	6.93	6.93	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	6.99	6.99	6.99	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	5.55	5.55	5.55	ChEMBL
H₂	HRH2	Human	Histamine	A	pKi	5.53	5.53	5.53	ChEMBL
M₁	ACM1	Human	Acetylcholine (muscarinic)	A	pKi	5.93	5.93	5.93	ChEMBL
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pKi	6.09	6.09	6.09	ChEMBL
M₃	ACM3	Human	Acetylcholine (muscarinic)	A	pKi	5.94	5.94	5.94	ChEMBL
M₄	ACM4	Human	Acetylcholine (muscarinic)	A	pKi	6.07	6.07	6.07	ChEMBL
M₅	ACM5	Human	Acetylcholine (muscarinic)	A	pKi	6.29	6.29	6.29	ChEMBL

Showing 1 to 12 of 12 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_2A	ADA2A	Human	Adrenoceptors	A	pIC50	5.40	5.40	5.40	ChEMBL
μ	OPRM	Human	Opioid	A	pIC50	6.24	6.24	6.24	ChEMBL
ADGRF1	AGRF1	Human	ADGRF	B2	pIC50	5.30	5.30	5.30	ChEMBL
apelin	APJ	Human	Apelin	A	pIC50	5.18	5.18	5.18	ChEMBL
AT₁	AGTR1	Human	Angiotensin	A	pIC50	5.38	5.38	5.38	ChEMBL
CX₃CR1	CX3C1	Human	Chemokine	A	pIC50	5.21	5.21	5.21	ChEMBL
FPR1	FPR1	Human	Formylpeptide	A	pIC50	4.77	4.77	4.77	ChEMBL
FPR3	FPR3	Human	Formylpeptide	A	pIC50	5.41	5.41	5.41	ChEMBL
GPR119	GP119	Human	GPR18, GPR55 and GPR119	A	pIC50	5.26	5.26	5.26	ChEMBL
GPR183	GP183	Human	A orphans	A	pIC50	5.32	5.32	5.32	ChEMBL
GPR35	GPR35	Human	A orphans	A	pIC50	5.38	5.38	5.38	ChEMBL
GPR65	PSYR	Human	A orphans	A	pIC50	5.31	5.31	5.31	ChEMBL
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pIC50	5.49	5.49	5.49	ChEMBL
NPS	NPSR1	Human	Neuropeptide S	A	pA2	8.98	8.98	8.98	Guide to Pharmacology
NPS	NPSR1	Human	Neuropeptide S	A	pIC50	7.35	8.43	9.02	ChEMBL
NPS	NPSR1	Human	Neuropeptide S	A	Potency	6.41	6.88	7.36	ChEMBL
S1P₁	S1PR1	Human	Lysophospholipid (S1P)	A	pIC50	5.47	5.47	5.47	ChEMBL

Showing 1 to 17 of 17 entries

NCGC 84

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

PubChem Guide To Pharmacology ChEMBL_compound_ids ChEMBL_compound_ids GPCRdb

Compound is not listed as a drug.