UCSF

ZINC05362545

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2006 26 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) 3.44 7.99 -33.47 2 5 0 71 390.27 4
Mid Mid (pH 6-8) 3.44 8.36 -38.4 3 5 1 72 391.278 4

Activity (Go SEA)

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