UCSF

ZINC06143637

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2006 32 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) 3.19 0.92 -49.74 2 7 1 80 441.479 8
Mid Mid (pH 6-8) 2.61 0.81 -59.62 1 7 1 77 441.479 8

Activity (Go SEA)

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