UCSF

ZINC55010860

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 23 No

Popular Name: (4E)-4-[[(3-bromo-5-fluoro-phenyl)methylamino]methylene]isoquinoline-1,3-dione (4E)-4-[[(3-bromo-5-fluoro-pheny…

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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) 3.16 6.77 -16.99 2 4 0 62 375.197 3 ↓

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

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