UCSF

ZINC63308092

Substance Information

In ZINC since Heavy atoms Benign functionality
May 28th, 2011 33 Yes

CAS Numbers: 475489-16-8 , [475488-34-7]

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) 4.50 15.31 -45.68 3 6 1 70 440.571 7
Hi High (pH 8-9.5) 9.12 20.37 -13.38 0 3 0 43 490.728 13
Lo Low (pH 4.5-6) 4.50 15.8 -84.54 4 6 2 72 441.579 7

Vendor Notes

Note Type Comments Provided By
Target IGF-1R Selleck Chemicals

Activity (Go SEA)

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

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