UCSF

ZINC00161986

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 10 Yes

Popular Name: 3-CHLORO-N-METHYLBENZYLAMINE 3-CHLORO-N-METHYLBENZYLAMINE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 39191-07-6 , 90389-46-1 , [39191-07-6] , [90389-46-1]

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) 2.15 -0.23 -40.36 2 1 1 17 156.636 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Boiling_Point 97? Alfa-Aesar
Boiling_Point 97° Alfa-Aesar

Activity (Go SEA)

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