UCSF

ZINC00163940

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 17 Yes

Popular Name: Benzyl-(1-furan-2-yl-but-3-enyl)-aminehydrochloride Benzyl-(1-furan-2-yl-but-3-enyl)…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1185294-16-9 , 696-22-0 , 93965-61-8 , [1185294-16-9]

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) 3.25 1.85 -36.38 2 2 1 29 228.315 6 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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