UCSF

ZINC07053276

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2006 21 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 3.18 -1.45 -16.92 1 6 0 91 310.306 4
Hi High (pH 8-9.5) 3.18 -0.98 -42.26 0 6 -1 94 309.298 4

Activity (Go SEA)

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