UCSF

ZINC17023644

Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2008 18 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 5.20 10.7 -4.38 0 1 0 12 237.346 4
Lo Low (pH 4.5-6) 5.20 11.02 -28.47 1 1 1 14 238.354 4

Activity (Go SEA)

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