UCSF

ZINC63952359

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 23 No

Popular Name: 4-hydroxy-N-[2-oxo-2-(3H-pyrazol-4-ylamino)ethyl]quinoline-3-carboxamide 4-hydroxy-N-[2-oxo-2-(3H-pyrazol…

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Annotations

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Vendors

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) -0.55 0.27 -24.38 3 8 0 116 311.301 4 ↓
Hi High (pH 8-9.5) 0.75 0.1 -54.21 2 8 -1 119 310.293 4 ↓

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

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