UCSF

ZINC44404843

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 25th, 2010 40 No

Popular Name: [(1S,2S,4aR,5R,8aR)-5-[(2-methoxy-5,6-dimethyl-4-oxo-pyran-3-yl)methyl]-1,4a-dimethyl-6-methylene-1- [(1S,2S,4aR,5R,8aR)-5-[(2-methox…

Find On: PubMed — Wikipedia — Google

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) 8.04 16.64 -15.51 1 6 0 86 556.784 11 ↓

Activity (Go SEA)

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