COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK833456
Chemical Name: 4-(4-chlorophenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)C(C)(C)C)nc2c(c1c1ccc(cc1)Cl)CCC2

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Molecular Weight: 384.93
Empirical Formula: C21H21ClN2OS

Physical State: Dry powder
Available Amount: 256 mg

Lipinsky:
logP: 5.619
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 79
Number of rings: 3

     

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