UCSF

ZINC05837914

Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 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) 5.33 14.73 -9.86 0 3 0 25 408.592 6
Lo Low (pH 4.5-6) 5.33 14.84 -48.62 1 3 0 26 409.6 6

Activity (Go SEA)

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