COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL290440
Chemical Name: ethyl(2Z)-3-(tert-butylamino)-2-[(2,4-dichloro-5-nitrophenyl)carbonyl]prop-2-enoate
Smiles: CCOC(=O)/C(=C\NC(C)(C)C)/C(=O)c1cc([N+](=O)[O-])c(cc1Cl)Cl

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Molecular Weight: 389.23
Empirical Formula: C16H18Cl2N2O5

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 3.542
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 1

     

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