UCSF

ZINC24992115

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2009 24 No

Download: MOL2 SDF SMILES Flexibase

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) 1.78 5.65 -10.48 1 7 0 79 355.46 5
Mid Mid (pH 6-8) 1.78 7.94 -32.78 2 7 1 80 356.468 5

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.