UCSF

ZINC02384146

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 13 Yes

Popular Name: 2-(4-Fluoro-1H-indol-3-yl)ethanamine 2-(4-Fluoro-1H-indol-3-yl)ethana…

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CAS Numbers: 467452-26-2 , [467452-26-2]

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) 1.19 3.42 -43.62 4 2 1 43 179.218 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5242925 IBM Patent Data

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