UCSF

ZINC06118993

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2006 14 Yes

Popular Name: 1-(Pyridin-2-ylcarbonyl)piperazine 1-(Pyridin-2-ylcarbonyl)piperazine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1071608-51-9 , 39639-98-0 , 39639-99-1 , [39639-98-0]

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 3.12 -45.27 2 4 1 50 192.242 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 219 - 221 Enamine Building Blocks
MP 219...221 Enamine Building Blocks
MP 231 - 233 Enamine Building Blocks
MP 231...233 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP0958287A1; US5998412; US6130220; US6143744 IBM Patent Data
Warnings IRRITANT Matrix Scientific

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