UCSF

ZINC00901306

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2004 8 No

Popular Name: BETA-METHYLCHOLINE CHLORIDE BETA-METHYLCHOLINE CHLORIDE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2382-43-6 , 60154-19-0 , 62-51-1 , 62314-25-4 , [62-51-1] , [62314-25-4]

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) -3.90 1.51 -27.88 1 2 1 20 118.2 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 160 TCI

Activity (Go SEA)

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

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