UCSF

ZINC04891800

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2006 17 Yes

Popular Name: (4-Methoxy-benzyl)-pyridin-3-ylmethyl-amine (4-Methoxy-benzyl)-pyridin-3-ylm…

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CAS Numbers: 355382-21-7 , [355382-21-7]

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) 1.72 5.79 -49.29 2 3 1 39 229.303 5 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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