UCSF

ZINC02021099

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 9 Yes

Popular Name: N-(2-Furylmethyl)ethanamine N-(2-Furylmethyl)ethanamine

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CAS Numbers: 14496-33-4 , 99357-37-6

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) 1.13 3.4 -36.39 2 2 1 30 126.179 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 58-60° Matrix Scientific
BP 73-75°/25 Torr Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

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