COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431254
Chemical Name: (2E)-2-(6-methyl-1H-benzimidazol-2-yl)-3-[4-(morpholin-4-yl)-3-nitrophenyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)/c1nc2c([nH]1)cc(cc2)C

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Molecular Weight: 389.41
Empirical Formula: C21H19N5O3

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 5.057
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 110
Number of rings: 4

     

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