UCSF

ZINC26385429

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2009 12 Yes

Popular Name: 1-(Piperidin-4-yl)piperazine 1-(Piperidin-4-yl)piperazine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1008-91-9 , 1217074-64-0 , 142013-66-9 , N/A , [1217074-64-0] , [142013-66-9]

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) -0.54 0.49 -91.52 4 3 2 36 171.288 1 ↓
Hi High (pH 8-9.5) -0.54 -0.92 -40.12 3 3 1 32 170.28 1 ↓
Hi High (pH 8-9.5) -2.26 -4.98 -18.32 4 9 0 134 299.283 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP1025100A1 IBM Patent Data

Activity (Go SEA)

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