COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148433
Chemical Name: (2E)-N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide
Smiles: COc1ccc(c(c1)OC)NC(=S)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 387.42
Empirical Formula: C18H17N3O5S

Physical State: Dry powder
Available Amount: 570 mg

Lipinsky:
logP: 3.422
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 137
Number of rings: 2

     

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