UCSF

ZINC40824893

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 25 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.35 7.81 -37.1 6 7 1 118 340.407 4
Hi High (pH 8-9.5) 2.35 7.87 -16.09 5 7 0 117 339.399 4

Activity (Go SEA)

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