UCSF

ZINC59710079

Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2011 20 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) -0.70 -0.07 -44.9 5 7 1 109 285.368 7
Hi High (pH 8-9.5) -0.70 -1.35 -13.82 4 7 0 105 284.36 7

Activity (Go SEA)

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