UCSF

ZINC02010908

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 11 Yes

Other Names:

6E-nonenoic acid

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.75 7.36 -43.3 0 2 -1 40 155.217 6
Lo Low (pH 4.5-6) 2.75 5.39 -5.21 1 2 0 37 156.225 6

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

No pre-computed analogs available. Try a structural similarity search.