UCSF

ZINC38539466

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 15 Yes

Popular Name: 1-(2-Fluoro-benzyl)-piperidin-3-ylamine hydrochloride 1-(2-Fluoro-benzyl)-piperidin-3-…

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CAS Numbers: 1261231-88-2 , 883530-84-5

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) 1.12 5.05 -31.3 3 2 1 30 209.288 2 ↓
Hi High (pH 8-9.5) 1.12 3.14 -44.25 3 2 1 31 209.288 2 ↓
Mid Mid (pH 6-8) 1.12 5.37 -112.49 4 2 2 32 210.296 2 ↓

Vendor Notes

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

Activity (Go SEA)

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