UCSF

ZINC19735172

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 1-(3,4-Dimethoxy-benzyl)-piperazine 1-(3,4-Dimethoxy-benzyl)-piperazine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 32231-07-5 , 471916-70-8 , 93088-18-7 , [93088-18-7]

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) 0.68 2.67 -45.1 2 4 1 38 237.323 4 ↓
Hi High (pH 8-9.5) 0.68 1.26 -6.35 1 4 0 34 236.315 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 16 - 18 Enamine Building Blocks
MP 27 - 40 Enamine Building Blocks
MP 27...40 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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