UCSF

ZINC16676584

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2008 33 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) 2.60 5.58 -51.17 2 9 1 118 496.631 7
Hi High (pH 8-9.5) 2.60 4.82 -39.92 1 9 0 120 495.623 7

Activity (Go SEA)

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