UCSF

ZINC19091651

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2008 11 Yes

Popular Name: 2-methyl-1-(3-pyridinyl)-1-propanone 2-methyl-1-(3-pyridinyl)-1-propa…

Find On: PubMed — Wikipedia — Google

CAS Number: 51227-29-3

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) 1.35 4.56 -6.11 0 2 0 30 149.193 2 ↓

Vendor Notes

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

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