COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507737
Chemical Name: (2E)-3-[2-(dimethylamino)-5-nitrophenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(ccc1N(C)C)[N+](=O)[O-])/c1nc2c([nH]1)cc(cc2)C

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Molecular Weight: 347.38
Empirical Formula: C19H17N5O2

Physical State: Dry powder
Available Amount: 337 mg

Lipinsky:
logP: 4.978
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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