UCSF

ZINC12006885

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 32 No

Popular Name: N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]-2-(4-nitrophenyl)acetamide N-[2-(4-ethyl-6-oxo-1H-pyrimidin…

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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) 2.82 11.26 -44.13 2 11 0 152 434.412 7 ↓
Mid Mid (pH 6-8) 3.28 10.93 -57.1 1 11 -1 155 433.404 7 ↓
Mid Mid (pH 6-8) 2.82 12.13 -21.81 2 11 0 152 434.412 7 ↓

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

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