UCSF

ZINC20745582

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 27 Yes

Popular Name: (4S)-1-(4-bromophenyl)-1'-methyl-spiro[5,7-dihydropyrazolo[4,5-e]pyridine-4,3'-indoline]-2',6-dione (4S)-1-(4-bromophenyl)-1'-methyl…

Find On: PubMed — Wikipedia — Google

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) 2.89 6.88 -10.9 1 6 0 71 423.27 1 ↓
Ref Reference (pH 7) 2.70 9.33 -9.34 1 6 0 67 423.27 1 ↓

Activity (Go SEA)

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