UCSF

ZINC26489083

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 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) -1.74 -0.39 -143.9 4 13 -2 197 398.272 4
Mid Mid (pH 6-8) -1.74 -1.58 -57.05 5 13 -1 194 399.28 4

Activity (Go SEA)

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