UCSF

ZINC00293097

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 19 Yes

Popular Name: (2,4-Dimethoxy-benzyl)-pyridin-3-ylmethyl-amine (2,4-Dimethoxy-benzyl)-pyridin-3…

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CAS Numbers: 418777-28-3 , [418777-28-3]

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) 1.70 -0.47 -44.5 2 4 1 47 259.329 6 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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