UCSF

ZINC95098811

Substance Information

In ZINC since Heavy atoms Benign functionality
August 12th, 2013 44 No

CAS Number: 78214-33-2

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) 5.39 4.87 -7.24 6 8 0 140 622.884 7

Vendor Notes

Note Type Comments Provided By
Target Interleukin-8(P10145)&Transcription factor AP-1(P05412)&Platelet basic protein(P02775)&Collagen alpha-1(III) chain(P02461)&Cytochrome P450 3A4(P08684)&Glial fibrillary acidic protein(P14136)&Caspase-3(P42574)&Interleukin-1 beta(P01584)&Tumor necrosis fact Herbal Ingredients Targets

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

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