UCSF

ZINC43204048

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2010 46 No

Popular Name: Foretinib Foretinib

Find On: PubMed — Wikipedia — Google

CAS Number: 849217-64-7

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) 4.38 10 -23.65 2 10 0 111 632.664 12 ↓
Ref Reference (pH 7) 4.57 7.07 -16.91 2 10 0 115 632.664 12 ↓
Mid Mid (pH 6-8) 4.38 12.26 -57.4 3 10 1 112 633.672 12 ↓
Mid Mid (pH 6-8) 4.57 9.35 -50.66 3 10 1 116 633.672 12 ↓

Activity (Go SEA)

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

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