UCSF

ZINC28659346

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2009 23 No

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) 0.68 5.15 -34.02 2 6 1 63 320.413 6
Hi High (pH 8-9.5) 0.68 2.98 -11.33 1 6 0 62 319.405 6

Activity (Go SEA)

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