UCSF

ZINC54919485

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 22 No

Popular Name: 2-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one 2-[(4-bromo-3-nitro-pyrazol-1-yl…

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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) 1.99 8.8 -21.32 0 8 0 98 364.159 3 ↓
Lo Low (pH 4.5-6) 1.99 9.2 -52.77 1 8 1 99 365.167 3 ↓

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

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