UCSF

ZINC32071296

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2009 30 Yes

Popular Name: (7R)-5'-chloro-1'-methyl-2',5-dioxo-3-phenyl-spiro[4,6-dihydrothieno[3,2-b]pyridine-7,3'-indoline]-2 (7R)-5'-chloro-1'-methyl-2',5-di…

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) 4.32 7.73 -57.73 1 6 -1 93 437.884 2 ↓
Ref Reference (pH 7) 4.13 10.33 -51.85 1 6 -1 90 437.884 2 ↓

Activity (Go SEA)

Rings

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

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