UCSF

ZINC08833951

Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2007 34 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) 3.43 -2.23 -57.05 2 8 1 89 506.362 6
Mid Mid (pH 6-8) 2.84 -2.34 -69.17 1 8 1 86 506.362 6

Activity (Go SEA)

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