UCSF

ZINC11616637

Substance Information

In ZINC since Heavy atoms Benign functionality
March 1st, 2008 33 Yes

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) 2.11 -4.38 -62.73 2 9 -1 144 480.538 10

Vendor Notes

Note Type Comments Provided By
Indications antihypercholesterolemic KeyOrganics Bioactives
Target HMG-CoA Reductase Selleck Chemicals
Target RAAS Selleck Chemicals
PUBCHEM_PATENT_ID WO2000042024A1; WO2000045817A1; WO2000045818A1; WO2000045819A1; WO2000049014A1 IBM Patent Data

Activity (Go SEA)

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