UCSF

ZINC65501447

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 22 Yes

Popular Name: 4-[[(4-ethoxypyrimidin-2-yl)amino]methyl]-2H-phthalazin-1-one 4-[[(4-ethoxypyrimidin-2-yl)amin…

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Download: MOL2 SDF SMILES Flexibase

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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) 2.05 4.12 -13.43 2 7 0 93 297.318 5 ↓
Lo Low (pH 4.5-6) 2.05 4.51 -51.65 3 7 1 94 298.326 5 ↓

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

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