COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK420367
Chemical Name: methyl2-{[(2E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)/C=C/c1ccc(cc1Cl)Cl

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Molecular Weight: 446.35
Empirical Formula: C22H17Cl2NO3S

Physical State: Dry powder
Available Amount: 1961 mg

Lipinsky:
logP: 7.976
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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