UCSF

ZINC13551720

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 20 Yes

Popular Name: Stearidonic Acid Stearidonic Acid

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CAS Number: 20290-75-9

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) 5.11 12.45 -45.54 0 2 -1 40 275.412 12 ↓

Vendor Notes

Note Type Comments Provided By
Patent Database Links EP1666092; US2004162437; US2007248586; US2008076164; US2008166781; US2008260929; US2008269329 ChEBI
UniProt Database Links FADS2_BOVIN; FADS2_HUMAN; FADS2_MACFA; FADS2_MOUSE; FADS2_PONAB; FADS2_RAT; FADS2_XENLA; SDA_BACSU ChEBI

Activity (Go SEA)

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