UCSF

ZINC39256010

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 14 Yes

Popular Name: bis[(1S)-cyclohex-2-en-1-yl]methanone bis[(1S)-cyclohex-2-en-1-yl]meth…

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) 3.14 8.29 -4.63 0 1 0 17 190.286 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0651893B1; US5755910 IBM Patent Data
PUBCHEM_PATENT_ID EP0678377A1; EP0678377B1; US5047383; US5688592 IBM Patent Data

Activity (Go SEA)

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