COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183976
Chemical Name: (2E)-N-[2-(4-chlorophenyl)-2H-benzotriazol-5-yl]-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(Nc1ccc2c(c1)nn(n2)c1ccc(cc1)Cl)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 419.83
Empirical Formula: C21H14ClN5O3

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 6.087
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 105
Number of rings: 4

     

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