COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL328742
Chemical Name: ethyl(2Z)-3-[5-(1H-indol-2-yl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]but-2-enoate
Smiles: CCOC(=O)/C=C(\N1N=C(CC1c1cc2c([nH]1)cccc2)c1cccc(c1)[N+](=O)[O-])/C

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Molecular Weight: 418.45
Empirical Formula: C23H22N4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.912
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 4

     

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