UCSF

ZINC05095159

Substance Information

In ZINC since Heavy atoms Benign functionality
January 20th, 2006 29 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 3.34 4.7 -9.73 3 7 0 106 388.427 5
Mid Mid (pH 6-8) 3.34 4.1 -9.59 3 7 0 106 388.427 5

Activity (Go SEA)

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