UCSF

ZINC19230200

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 17 Yes

Popular Name: 1-(2,5-Dimethoxy-benzyl)-piperazine 1-(2,5-Dimethoxy-benzyl)-piperazine

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CAS Numbers: 356085-57-9 , 374897-99-1

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) 1.08 2.15 -40.63 2 4 1 38 237.323 4 ↓
Hi High (pH 8-9.5) 1.08 0.74 -5.45 1 4 0 34 236.315 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 141-143? Alfa-Aesar
Melting_Point 141-143° Alfa-Aesar
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% )

No pre-computed analogs available. Try a structural similarity search.