UCSF

ZINC13548878

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 30 No

Popular Name: Spinasterol Spinasterol

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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) 7.87 13.69 -1.5 1 1 0 20 412.702 5 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0151385A2; EP0587374A3; EP0920852A2; EP1051075A2; US4400295; US4929603; US5024846; US5326579; US5370890; WO1990002788A1; WO1991005836A1; WO1994012044A1; WO1999038379A2; WO2000038725A1; WO2000052029A1; WO2000061694A1; WO2000069404A1 IBM Patent Data

Activity (Go SEA)

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

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