UCSF

ZINC20309797

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 36 No

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) 2.28 7.77 -85.65 2 10 0 122 500.548 11
Hi High (pH 8-9.5) 2.28 8.8 -142.77 1 10 -1 125 499.54 11

Activity (Go SEA)

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