UCSF

ZINC65312179

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2011 33 Yes

Popular Name: 5-[(3-methoxyphenyl)methyl]-4-oxo-N-(2-pyridylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide 5-[(3-methoxyphenyl)methyl]-4-ox…

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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) 3.58 8.37 -16.44 1 8 0 91 439.475 6 ↓
Lo Low (pH 4.5-6) 3.58 8.78 -52.18 2 8 1 92 440.483 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.