UCSF

ZINC33686839

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2009 31 No

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) 0.42 -3.76 -17.16 6 10 0 166 434.397 3
Hi High (pH 8-9.5) 0.42 -2.77 -58.05 5 10 -1 169 433.389 3

Activity (Go SEA)

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