UCSF

ZINC12496501

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 30 Yes

CAS Number: 81131-70-6

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) 2.15 6.33 -55.1 3 7 -1 127 423.526 11

Vendor Notes

Note Type Comments Provided By
Therapy antihyperlipidemic, HMGCoA reductase inhibitor SMDC Pharmakon

Activity (Go SEA)

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