UCSF

ZINC03882042

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 31 No

Popular Name: TRIAMCINOLONE ACETONIDE TRIAMCINOLONE ACETONIDE

Find On: PubMed — Wikipedia — Google

CAS Number: 76-25-5

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) 2.56 5.55 -18.33 2 6 0 93 434.504 2 ↓

Vendor Notes

Note Type Comments Provided By
Therapy antiinflammatory SMDC Pharmakon

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z80951-4-O NIH3T3 (Fibroblasts) (cluster #4 Of 4), Other Other 2500 0.25 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z80951 Z80951 NIH3T3 (Fibroblasts) 1600 0.26 Functional ≤ 10μM

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