UCSF

ZINC54917860

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 20 Yes

Popular Name: N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]phthalazin-1-amine N-[3-(5-methyl-1H-pyrazol-4-yl)p…

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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) 2.15 6.41 -31.95 3 5 1 68 268.344 5 ↓
Mid Mid (pH 6-8) 2.15 6.32 -13.56 2 5 0 66 267.336 5 ↓

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

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