UCSF

ZINC23565228

Substance Information

In ZINC since Heavy atoms Benign functionality
January 4th, 2009 25 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.64 7.86 -13.73 1 5 0 56 337.423 6
Lo Low (pH 4.5-6) 2.64 8.32 -43.97 2 5 1 57 338.431 6

Activity (Go SEA)

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