UCSF

ZINC08926666

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2007 35 No

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) 3.84 11.17 -46.39 2 7 1 81 479.597 10
Mid Mid (pH 6-8) 3.25 11.95 -55.2 1 7 1 77 479.597 10

Activity (Go SEA)

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