UCSF

ZINC95098841

Substance Information

In ZINC since Heavy atoms Benign functionality
August 12th, 2013 30 No

CAS Number: 512-04-9

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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) 5.93 10.62 -5.26 1 3 0 39 414.63 0

Vendor Notes

Note Type Comments Provided By
Target Caspase-8(Q14790)&Apoptosis regulator BAX(Q07812)&Cellular tumor antigen p53(P04637)&Cyclin-dependent kinase inhibitor 1(P38936)&Interleukin-6(P05231)&Tumor necrosis factor(P01375)&Lipopolysaccharide-binding protein(P18428)&Monocyte differentiation antige Herbal Ingredients Targets

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

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