UCSF

ZINC40341784

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 38 Yes

Popular Name: (4S)-4-(4-benzyloxyphenyl)-5-(3-imidazol-1-ylpropyl)-3-(p-tolyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6- (4S)-4-(4-benzyloxyphenyl)-5-(3-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 5.06 17.02 -44.27 2 7 1 77 504.614 9 ↓
Mid Mid (pH 6-8) 5.06 16.5 -21.82 1 7 0 76 503.606 9 ↓

Activity (Go SEA)

Rings

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

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