UCSF

ZINC19261057

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 19 Yes

Popular Name: N'-(1-Benzylpiperidin-4-yl)-N,N-dimethylethane-1,2-diamine dihydrochloride N'-(1-Benzylpiperidin-4-yl)-N,N-…

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CAS Numbers: , 1332531-09-5

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) 1.95 4.63 -38.19 2 3 1 23 262.421 6 ↓
Hi High (pH 8-9.5) 1.95 5.69 -35.25 2 3 1 20 262.421 6 ↓
Mid Mid (pH 6-8) 1.95 8.2 -84.93 3 3 2 21 263.429 6 ↓
Mid Mid (pH 6-8) 1.95 7.12 -112.2 3 3 2 24 263.429 6 ↓

Vendor Notes

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

Activity (Go SEA)

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