UCSF

ZINC04962369

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2006 14 Yes

Popular Name: 2-Methoxy-6,7,8,9-tetrahydro-benzocyclohepten-5-one 2-Methoxy-6,7,8,9-tetrahydro-ben…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 6500-65-8 , [6500-65-8]

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) 2.78 1.2 -6.29 0 2 0 26 190.242 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem

Activity (Go SEA)

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