UCSF

ZINC28642878

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 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) 2.34 6.73 -16.64 1 6 0 65 339.395 8
Lo Low (pH 4.5-6) 2.34 7.4 -32.91 2 6 1 67 340.403 8

Activity (Go SEA)

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