UCSF

ZINC00378545

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2005 16 Yes

Popular Name: (2-Methyl-benzyl)-pyridin-3-ylmethyl-amine (2-Methyl-benzyl)-pyridin-3-ylme…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 510723-58-7 , [510723-58-7]

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) 2.06 7.09 -45.61 2 2 1 29 213.304 4 ↓
Hi High (pH 8-9.5) 2.06 5.73 -5.35 1 2 0 25 212.296 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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