UCSF

ZINC35457267

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 33 No

Popular Name: (1R,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aS,13bS)-9-hydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3, (1R,3aS,5aR,5bR,7aR,9R,11aR,11bR…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 7.04 11.82 -50.29 1 3 -1 60 455.703 2 ↓
Lo Low (pH 4.5-6) 7.04 10.02 -4.89 2 3 0 58 456.711 2 ↓

Activity (Go SEA)

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