UCSF

ZINC44018534

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2010 37 No

Popular Name: [(Z)-[(1R,4aR,4bS,8aS,10aS)-1-[2-(3-furyl)ethyl]-4b,8,8,10a-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decah [(Z)-[(1R,4aR,4bS,8aS,10aS)-1-[2…

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) 5.10 2.99 -7.36 4 8 0 121 537.767 8 ↓
Mid Mid (pH 6-8) 5.10 3.64 -39.6 5 8 1 123 538.775 8 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.