UCSF

ZINC33829945

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 29 No

CAS Number: 474-67-9

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) 7.37 12.95 -1.35 1 1 0 20 398.675 4

Vendor Notes

Note Type Comments Provided By
Target Mitogen-activated protein kinase kinase kinase 5(Q99683) Herbal Ingredients Targets

Activity (Go SEA)

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

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