COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443348
Chemical Name: propan-2-yl5-{[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino}-4-cyano-3-methylthiophene-2-carboxylate
Smiles: N#Cc1c(NC(=O)/C=C/c2ccc3c(c2)OCO3)sc(c1C)C(=O)OC(C)C

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Molecular Weight: 398.44
Empirical Formula: C20H18N2O5S

Physical State: Dry powder
Available Amount: 1488 mg

Lipinsky:
logP: 5.552
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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