UCSF

ZINC46059024

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2010 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) -0.06 3.98 -48.64 1 6 1 68 319.447 8
Hi High (pH 8-9.5) -0.06 1.74 -16.71 0 6 0 67 318.439 8

Activity (Go SEA)

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