UCSF

ZINC07057361

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2006 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.70 -2.04 -61.65 1 5 -1 86 346.428 5
Hi High (pH 8-9.5) 4.70 -1.51 -117.76 0 5 -2 88 345.42 5

Activity (Go SEA)

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