UCSF

ZINC16026132

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2008 28 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) 0.68 4.25 -18.35 1 7 0 82 398.488 5
Mid Mid (pH 6-8) 0.68 6.46 -58.15 2 7 1 83 399.496 5

Activity (Go SEA)

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