UCSF

ZINC06499160

Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2006 35 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) 2.01 2.34 -45.49 2 9 1 98 483.541 9
Mid Mid (pH 6-8) 1.42 2.79 -50.55 1 9 1 95 483.541 9

Activity (Go SEA)

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