UCSF

ZINC03785276

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2005 24 Yes

Popular Name: OMEGA-3-ACID ESTERS (EPA shown) OMEGA-3-ACID ESTERS (EPA shown)

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CAS Number: 86227-47-6

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) 6.08 15.63 -5.46 0 2 0 26 330.512 15 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 9.83e-05 g/l DrugBank-approved
Therapy hypolipidemic SMDC Pharmakon

Activity (Go SEA)

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