UCSF

ZINC64543254

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 21 Yes

Popular Name: 4-(4-pyrrolidin-1-ylphthalazin-1-yl)morpholine 4-(4-pyrrolidin-1-ylphthalazin-1…

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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) 2.44 7.88 -22.61 1 5 1 43 285.371 2 ↓
Mid Mid (pH 6-8) 2.44 8.54 -22.45 1 5 1 43 285.371 2 ↓
Mid Mid (pH 6-8) 2.44 7.71 -11.88 0 5 0 41 284.363 2 ↓

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Rings

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

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