UCSF

ZINC38533174

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 14 Yes

Popular Name: 2-(3-methoxyphenyl)piperazine 2-(3-methoxyphenyl)piperazine

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CAS Numbers: 790164-75-9 , [790164-75-9]

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) 1.01 3.11 -122.28 4 3 2 42 194.278 2 ↓
Hi High (pH 8-9.5) 1.01 1.78 -37.08 3 3 1 38 193.27 2 ↓
Hi High (pH 8-9.5) 1.01 0.66 -3.64 2 3 0 33 192.262 2 ↓
Hi High (pH 8-9.5) 1.01 2.01 -39.35 3 3 1 38 193.27 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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