UCSF

ZINC00185755

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2005 14 Yes

Popular Name: Furan-2-ylmethyl-pyridin-2-ylmethyl-amine Furan-2-ylmethyl-pyridin-2-ylmet…

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CAS Numbers: 1158770-65-0 , 247571-56-8 , [247571-56-8]

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) 0.98 4.59 -39.36 2 3 1 43 189.238 4 ↓
Lo Low (pH 4.5-6) 0.98 4.85 -108.66 3 3 2 44 190.246 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.