UCSF

ZINC14988559

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 15 Yes

Popular Name: 3-[(4-Aminopiperidin-1-yl)methyl]phenol 3-[(4-Aminopiperidin-1-yl)methyl…

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CAS Numbers: 946679-47-6 , [946679-47-6]

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) 0.50 0.4 -44.63 4 3 1 51 207.297 2 ↓
Hi High (pH 8-9.5) 0.50 3 -56.65 3 3 0 54 206.289 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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