UCSF

ZINC95098829

Substance Information

In ZINC since Heavy atoms Benign functionality
August 12th, 2013 33 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 2.11 5.43 -47.17 2 6 -1 107 482.707 7

Vendor Notes

Note Type Comments Provided By
Target Corticosteroid 11-beta-dehydrogenase isozyme 2(P80365)&Alanine aminotransferase 2(Q8TD30)&RAC-alpha serine/threonine-protein kinase(P31749) Herbal Ingredients Targets

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

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