COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL290126
Chemical Name: 2-({[(2E)-3-(4-nitrophenyl)prop-2-enoyl]carbamothioyl}amino)-N-(prop-2-en-1-yl)benzamide
Smiles: C=CCNC(=O)c1ccccc1NC(=S)NC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 410.45
Empirical Formula: C20H18N4O4S

Physical State: Dry powder
Available Amount: 170 mg

Lipinsky:
logP: 4.163
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 148
Number of rings: 2

     

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