UCSF

ZINC05175865

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2006 27 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) 4.91 8.03 -12.58 1 5 0 72 384.432 5
Hi High (pH 8-9.5) 5.37 6.44 -53.93 0 5 -1 75 383.424 5

Activity (Go SEA)

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