UCSF

ZINC07051284

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2006 23 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) 2.06 -9.24 -15.55 3 7 0 115 376.843 5
Hi High (pH 8-9.5) 2.06 -8.66 -42.32 2 7 -1 117 375.835 5

Activity (Go SEA)

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