COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826480
Chemical Name: methyl2-{[({3-cyano-5-[(2-methoxyphenyl)carbamoyl]-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl}sulfanyl)acetyl]amino}benzoate
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C(=O)OC)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

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Molecular Weight: 568.65
Empirical Formula: C31H28N4O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.606
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 154
Number of rings: 4

     

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