COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151217
Chemical Name: (2Z)-3-(3,6-dichloro-2-methoxyphenyl)-2-(4,5-dimethoxy-2-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1c(Cl)ccc(c1OC)Cl)/c1cc(OC)c(cc1[N+](=O)[O-])OC

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Molecular Weight: 409.23
Empirical Formula: C18H14Cl2N2O5

Physical State: Dry powder
Available Amount: 199 mg

Lipinsky:
logP: 5.43
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 97
Number of rings: 2

     

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