COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK887196
Chemical Name: ethyl2-[({[3-cyano-6-methyl-5-(phenylcarbamoyl)-4-(thiophen-2-yl)-1,4-dihydropyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSC2=C(C#N)C(C(=C(N2)C)C(=O)Nc2ccccc2)c2cccs2)sc2c1CCCC2

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Molecular Weight: 618.8
Empirical Formula: C31H30N4O4S3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.586
Rotatable bonds: 8
H-donors: 3
H-acceptors: 4
PSA: 202
Number of rings: 5

     

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