COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK543542
Chemical Name: prop-2-en-1-yl6-({2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)Nc1cc(OC)c(cc1OC)Cl

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Molecular Weight: 554.07
Empirical Formula: C28H28ClN3O5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.063
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 3

     

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