UCSF

ZINC06622427

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 19 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) -1.37 -0.35 -33.2 3 9 0 130 266.213 2
Hi High (pH 8-9.5) -0.91 -2.41 -67.85 2 9 -1 133 265.205 2

Activity (Go SEA)

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