UCSF

ZINC12416968

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2008 9 Yes

Popular Name: N-methyl-1-pyrazin-2-ylmethanamine N-methyl-1-pyrazin-2-ylmethanamine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 120739-79-9 , 167300-07-4 , [120739-79-9]

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) 0.03 0.73 -39.53 2 3 1 42 124.167 2 ↓
Hi High (pH 8-9.5) 2.88 11.94 -63.76 1 13 -1 171 558.564 13 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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