UCSF

ZINC16099572

Substance Information

In ZINC since Heavy atoms Benign functionality
August 21st, 2008 25 Yes

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) 4.30 6.23 -10.92 1 5 0 68 374.849 6
Hi High (pH 8-9.5) 4.30 6.3 -37.67 0 5 -1 70 373.841 6

Activity (Go SEA)

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