UCSF

ZINC24115939

Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2009 34 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) 4.40 12.69 -73.62 1 6 0 74 466.553 11
Hi High (pH 8-9.5) 4.40 10.4 -55.4 0 6 -1 73 465.545 11

Activity (Go SEA)

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