UCSF

ZINC16661508

Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2008 30 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) -0.08 -0.8 -31.4 2 12 0 165 458.474 7
Hi High (pH 8-9.5) -0.08 -1.23 -68.89 1 12 -1 167 457.466 7

Activity (Go SEA)

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