UCSF

ZINC19737387

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 17 Yes

Popular Name: N-Benzyl-2-piperazin-1-ylacetamide N-Benzyl-2-piperazin-1-ylacetamide

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CAS Numbers: 827614-58-4 , 828911-01-9

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) 0.65 2.34 -41.13 3 4 1 49 234.323 4 ↓
Hi High (pH 8-9.5) 0.65 0.9 -8.8 2 4 0 44 233.315 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 218-221° Oakwood Chemical
MP 49 - 51 Enamine Building Blocks
MP 49...51 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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