UCSF

ZINC06162518

Substance Information

In ZINC since Heavy atoms Benign functionality
March 10th, 2006 33 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) 2.71 2.02 -18.52 1 8 0 134 445.523 6
Mid Mid (pH 6-8) 2.71 1.84 -52.44 2 8 1 135 446.531 6

Activity (Go SEA)

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