COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553898
Chemical Name: (2Z)-2-cyano-N-(2,3-dimethylphenyl)-3-{4-[(4-methylphenyl)sulfanyl]phenyl}prop-2-enamide
Smiles: N#C/C(=C/c1ccc(cc1)Sc1ccc(cc1)C)/C(=O)Nc1cccc(c1C)C

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Molecular Weight: 398.53
Empirical Formula: C25H22N2OS

Physical State: Dry powder
Available Amount: 1500 mg

Lipinsky:
logP: 6.997
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 78
Number of rings: 3

     

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