UCSF

ZINC72266312

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2012 33 No

Popular Name: PF299804 PF299804

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1110813-31-4 , [1110813-31-4]

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) 5.02 12.32 -49.17 3 7 1 81 470.956 7 ↓
Ref Reference (pH 7) 5.20 7.64 -14.65 2 7 0 83 469.948 7 ↓
Hi High (pH 8-9.5) 0.90 3.61 -8.89 2 3 0 46 192.262 2 ↓
Mid Mid (pH 6-8) 5.02 10.08 -10.74 2 7 0 79 469.948 7 ↓
Mid Mid (pH 6-8) 5.20 9.88 -58.8 3 7 1 84 470.956 7 ↓

Vendor Notes

Note Type Comments Provided By
Target EGFR Selleck Chemicals

Activity (Go SEA)

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