COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185172
Chemical Name: (2E)-N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide
Smiles: COc1ccc(cc1Cl)n1nc2c(n1)cc(c(c2)C)NC(=O)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 498.32
Empirical Formula: C23H17Cl2N5O4

Physical State: Dry powder
Available Amount: 328 mg

Lipinsky:
logP: 6.729
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 114
Number of rings: 4

     

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