COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826324
Chemical Name: ethyl4-{[(5-cyano-6-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridin-3-yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1=C(C)NC(=C(C1c1ccccc1)C#N)SCC(=O)NC1CCCCC1

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Molecular Weight: 558.7
Empirical Formula: C31H34N4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.01
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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