UCSF

ZINC06623496

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 22 No

Download: MOL2 SDF SMILES Flexibase

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) 2.77 -0.81 -20.16 1 7 0 115 317.326 4
Hi High (pH 8-9.5) 2.77 -0.34 -42.3 0 7 -1 117 316.318 4

Activity (Go SEA)

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