UCSF

ZINC39090916

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2010 11 Yes

Popular Name: 3-(1H-1,2,4-triazol-1-yl)piperidine 3-(1H-1,2,4-triazol-1-yl)piperidine

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CAS Numbers: 1258651-92-1 , 774511-83-0 , [774511-83-0]

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) -0.72 4.4 -46.15 2 4 1 47 153.209 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 244 - 246 Enamine Building Blocks
MP 244...246 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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