COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK195328
Chemical Name: methyl3-{[(2E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino}-4-(4-ethylpiperazin-1-yl)benzoate
Smiles: CCN1CCN(CC1)c1ccc(cc1NC(=O)/C=C/c1ccc(cc1Cl)Cl)C(=O)OC

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Molecular Weight: 462.38
Empirical Formula: C23H25Cl2N3O3

Physical State: Dry powder
Available Amount: 449 mg

Lipinsky:
logP: 5.091
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 61
Number of rings: 3

     

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