UCSF

ZINC05924425

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 20 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) 1.62 -2.92 -15.49 1 8 0 117 314.348 5
Hi High (pH 8-9.5) 1.62 -2.42 -50.52 0 8 -1 119 313.34 5

Activity (Go SEA)

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