UCSF

ZINC95098845

Substance Information

In ZINC since Heavy atoms Benign functionality
August 12th, 2013 20 Yes

CAS Number: 13956-29-1

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) 5.69 6.38 -3.48 2 2 0 40 272.388 3

Vendor Notes

Note Type Comments Provided By
Target Platelet glycoprotein 4(P16671)&Peroxisome proliferator-activated receptor gamma(P37231)&Transcription factor p65(Q04206)&Cell division protein kinase 2(P24941)&Kinetochore protein Nuf2(Q9BZD4)&M-phase inducer phosphatase 3(P30307) Herbal Ingredients Targets

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

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