COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK548894
Chemical Name: prop-2-en-1-yl4-[4-(benzyloxy)-3-methoxyphenyl]-6-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C#N)SCC(=O)Nc1ccc(cc1)Br

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Molecular Weight: 660.59
Empirical Formula: C33H30BrN3O5S

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 6.937
Rotatable bonds: 11
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 4

     

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