COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK749402
Chemical Name: N-{2-[(2E)-2-{[3-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methylidene}hydrazinyl]-2-oxoethyl}-1,3-benzodioxole-5-carboxamide(non-preferredname)
Smiles: COc1cc(ccc1OC)c1n[nH]cc1/C=N/NC(=O)CNC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 451.44
Empirical Formula: C22H21N5O6

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 1.789
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 136
Number of rings: 4

     

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