UCSF

ZINC05808390

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2006 28 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) 3.36 10.14 -13.71 1 5 0 55 414.552 6
Lo Low (pH 4.5-6) 3.36 10.19 -50.82 2 5 0 56 415.56 6

Activity (Go SEA)

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