UCSF

ZINC35947032

Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2009 32 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) -1.60 0.56 -62.65 5 10 -1 181 441.416 2
Mid Mid (pH 6-8) -1.60 1.88 -55.19 6 10 0 182 442.424 2

Activity (Go SEA)

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