UCSF

ZINC31172276

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2009 31 No

Popular Name: N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-[[2-(4-methoxyanilino)-2-oxo-ethyl]-methyl-amino]acet N-[2-(4-fluorophenyl)-5-methyl-p…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.97 9.3 -66.78 3 8 1 90 426.472 8 ↓
Hi High (pH 8-9.5) 2.97 7.05 -26.26 2 8 0 88 425.464 8 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )