UCSF

ZINC26478839

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 17 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) -0.41 -2.36 -38.37 4 7 0 114 259.287 4
Mid Mid (pH 6-8) -0.41 -2.43 -19.74 4 7 0 111 259.287 4

Activity (Go SEA)

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