UCSF

ZINC08219968

Substance Information

In ZINC since Heavy atoms Benign functionality
July 4th, 2006 31 No

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) 4.71 -5.89 -7.11 4 4 0 80 436.677 6

Vendor Notes

Note Type Comments Provided By
Reactome Database Links REACT_10009; REACT_10015; REACT_10025; REACT_10038; REACT_10044; REACT_9985 ChEBI

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Synthesis of bile acids and bile salts via 27-hydroxycholesterol
Synthesis of bile acids and bile salts via 7alpha-hydroxycholesterol

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