COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472673
Chemical Name: methyl2-{[(2E)-2-cyano-3-(pentafluorophenyl)prop-2-enoyl]amino}-5-(propan-2-yl)thiophene-3-carboxylate
Smiles: N#C/C(=C\c1c(F)c(F)c(c(c1F)F)F)/C(=O)Nc1sc(cc1C(=O)OC)C(C)C

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Molecular Weight: 444.38
Empirical Formula: C19H13F5N2O3S

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 6.428
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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