UCSF

ZINC19282673

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 11 Yes

Popular Name: [(6-chloropyridin-3-yl)methyl]dimethylamine [(6-chloropyridin-3-yl)methyl]di…

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CAS Numbers: 221146-31-2 , [221146-31-2]

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) 1.52 5.13 -42.41 1 2 1 17 171.651 2 ↓
Hi High (pH 8-9.5) 1.52 2.59 -4.35 0 2 0 16 170.643 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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