UCSF

ZINC20294434

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 20 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) 1.29 1.47 -48.07 6 6 1 103 297.766 4
Hi High (pH 8-9.5) 1.29 -0.48 -24.01 5 6 0 101 296.758 4

Activity (Go SEA)

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