UCSF

ZINC71789706

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2012 18 No

Popular Name: Store at 2-8°C Store at 2-8°C

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CAS Number: 20554-84-1

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.09 6.94 -12.78 0 3 0 39 248.322 0 ↓

Vendor Notes

Note Type Comments Provided By
Notes Anti-inflammatory agent Apollo Scientific Bioactives

Activity (Go SEA)

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

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