UCSF

ZINC01711338

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 9 No

Popular Name: 2-Methyl-4-oxopentanoic acid 2-Methyl-4-oxopentanoic acid

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CAS Numbers: 614759-21-6 , 6641-83-4 , [6641-83-4]

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) 0.12 3.18 -46.44 0 3 -1 57 129.135 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 165 / 40 TCI
Purity 97% Fluorochem

Activity (Go SEA)

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