UCSF

ZINC43021278

Substance Information

In ZINC since Heavy atoms Benign functionality
May 6th, 2010 33 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) -1.00 3.92 -50.88 6 11 0 173 474.543 10
Hi High (pH 8-9.5) -1.00 3.64 -52.43 5 11 -1 171 473.535 10

Activity (Go SEA)

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