COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333596
Chemical Name: (2Z)-3-(3-bromophenyl)-2-(4,5-dimethoxy-2-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cccc(c1)Br)/c1cc(OC)c(cc1[N+](=O)[O-])OC

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Molecular Weight: 389.21
Empirical Formula: C17H13BrN2O4

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 5.165
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 2

     

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