COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219962
Chemical Name: methyl4-(4-ethylpiperazin-1-yl)-3-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}benzoate
Smiles: CCN1CCN(CC1)c1ccc(cc1NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-])C(=O)OC

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Molecular Weight: 438.48
Empirical Formula: C23H26N4O5

Physical State: Dry powder
Available Amount: 183 mg

Lipinsky:
logP: 4.076
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 3

     

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