UCSF

ZINC37693678

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2009 14 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) -0.67 -2.49 -14.01 1 4 0 58 237.346 1
Mid Mid (pH 6-8) -0.67 -0.34 -55.52 2 4 1 59 238.354 1

Activity (Go SEA)

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