UCSF

ZINC09286900

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 13 Yes

Popular Name: 2-{[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]amino}ethanol dihydrochloride 2-{[(1,3,5-trimethyl-1H-pyrazol-…

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CAS Number: 400877-08-9

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) -0.31 0.77 -40.84 3 4 1 55 184.263 4 ↓

Vendor Notes

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

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