UCSF

ZINC38220408

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2010 12 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) 1.35 -1.57 -10.49 2 4 0 75 166.132 2
Hi High (pH 8-9.5) 1.35 0.77 -53.65 1 4 -1 77 165.124 2

Activity (Go SEA)

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