UCSF

ZINC38655750

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 31 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) 1.47 -2.08 -13.98 5 9 0 146 434.441 8
Hi High (pH 8-9.5) 1.47 -1.35 -44.58 4 9 -1 149 433.433 8

Activity (Go SEA)

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