UCSF

ZINC08897208

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 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) 5.12 13.19 -47.63 2 6 1 71 465.614 10
Mid Mid (pH 6-8) 4.09 13.86 -44.46 1 6 1 68 465.614 11

Activity (Go SEA)

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