UCSF

ZINC03666919

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 26 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) 0.36 7.33 -13.19 1 8 0 114 348.318 4
Hi High (pH 8-9.5) 0.54 5.84 -43.09 0 8 -1 120 347.31 4

Activity (Go SEA)

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