COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886400
Chemical Name: 2-{[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: N#CC1=C(SCC(=O)N(c2ccccc2)c2ccccc2)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C

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Molecular Weight: 554.11
Empirical Formula: C32H28ClN3O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.97
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 98
Number of rings: 5

     

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