UCSF

ZINC02086647

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 41 No

Popular Name: (6S,6aS)-5-benzoyl-6-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-9,9-dimethyl-6,6a,8,11-tetrahydrobenzo[c] (6S,6aS)-5-benzoyl-6-[5-(2-chlor…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 7.53 15.83 -13.17 1 8 0 108 568.029 4 ↓

Activity (Go SEA)

Rings

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

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