UCSF

ZINC43409414

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 42 No

Popular Name: (5R,5aR,8aR,9S)-9-[[(2S,4aS,6R,7R,8S,8aR)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d (5R,5aR,8aR,9S)-9-[[(2S,4aS,6R,7…

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) 1.76 3.82 -18.64 2 12 0 141 586.59 5 ↓

Activity (Go SEA)

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