UCSF

ZINC09272909

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 36 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) 6.00 13.71 -45.76 2 6 1 71 534.504 11
Mid Mid (pH 6-8) 5.42 14.51 -55.72 1 6 1 68 534.504 11

Activity (Go SEA)

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