COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK549179
Chemical Name: benzyl4-(2-chlorophenyl)-5-cyano-6-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCN(C(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)OCc1ccccc1)c1ccccc1Cl)CC

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Molecular Weight: 510.06
Empirical Formula: C27H28ClN3O3S

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 4.89
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 3

     

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