UCSF

ZINC19995842

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 26 No

Popular Name: (5E)-1-(4-fluorophenyl)-5-[[2-(1-piperidyl)ethylamino]methylene]hexahydropyrimidine-2,4,6-trione (5E)-1-(4-fluorophenyl)-5-[[2-(1…

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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) 0.91 6.96 -50.65 3 7 1 88 361.397 5 ↓
Ref Reference (pH 7) 0.91 6.96 -50.96 3 7 1 88 361.397 5 ↓
Hi High (pH 8-9.5) 0.91 4.74 -9.25 2 7 0 87 360.389 5 ↓
Hi High (pH 8-9.5) 0.91 4.74 -9.25 2 7 0 87 360.389 5 ↓

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

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