UCSF

ZINC19371697

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 9 Yes

Popular Name: Piperazine-2-carboxamide Piperazine-2-carboxamide

Find On: PubMed — Wikipedia — Google

CAS Numbers: 138681-31-9 , 159572-93-7 , 84501-64-4 , 98-96-4 , [138681-31-9] , [84501-64-4]

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) -1.33 -4.49 -50.03 5 4 1 72 130.171 1 ↓
Mid Mid (pH 6-8) -1.33 -4.61 -36.15 5 4 1 72 130.171 1 ↓
Mid Mid (pH 6-8) -1.33 -5.9 -9.74 4 4 0 67 129.163 1 ↓
Lo Low (pH 4.5-6) -1.33 -3.21 -118.52 6 4 2 76 131.179 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 142 - 144 Enamine Building Blocks
MP 142...144 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
UniProt Database Links RSAM_PSESP ChEBI

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