COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK141875
Chemical Name: (2E)-N-[(4-butylphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide
Smiles: CCCCc1ccc(cc1)NC(=S)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 383.47
Empirical Formula: C20H21N3O3S

Physical State: Dry powder
Available Amount: 241 mg

Lipinsky:
logP: 5.75
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 2

     

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