UCSF

ZINC26816369

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2009 21 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) -1.34 0.62 -60.51 4 10 -1 159 316.234 5
Mid Mid (pH 6-8) -1.34 1.78 -141.42 3 10 -2 162 315.226 5

Activity (Go SEA)

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