UCSF

ZINC38810889

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2010 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) 6.70 12.17 -23.32 2 8 0 120 426.432 5
Hi High (pH 8-9.5) 6.70 13.19 -73.26 1 8 -1 123 425.424 5

Activity (Go SEA)

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