(2Z)-5-amino-2-[(2-hydroxyphenyl)methylidene]-6-morpholin-4-yl-1H-imidazo[1,2-a]pyrimidine-3,7-dione

Formula:C17H17N5O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (2Z)-5-amino-2-[(2-hydroxyphenyl)methylidene]-6-morpholin-4-yl-1H-imidazo[1,2-a]pyrimidine-3,7-dione is a drug-like molecule.

MolName(2Z)-5-amino-2-[(2-hydroxyphenyl)methylidene]-6-morpholin-4-yl-1H-imidazo[1,2-a]pyrimidine-3,7-dione
MolecularFormulaC17H17N5O4
SmilesNC(N(C(/C(/N1)=C/c(cccc2)c2O)=O)C1=NC1=O)=C1N1CCOCC1
InChIInChI=1S/C17H17N5O4/c18-14-13(21-5-7-26-8-6-21)15(24)20-17-19-11(16(25)22(14)17)9-10-3-1-2-4-12(10)23/h1-4,9,23H,5-8,18H2,(H,19,20,24)
InChIKWCUNVPFYZXHEFG-UHFFFAOYSA-N
TotalMolweight355.353
Molweight355.353
MonoisotopicMass355.128055
CLogP-0.2538
CLogS-3.451
H Acceptors9
H Donors3
TotalSurfaceArea250.83
Relative PSA0.37683
PolarSurfaceArea120.49
Druglikeness4.2289
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionspolar activated DB
Shape Index0.53846
Fragments1
Non HAtoms26
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond2
Rings Closures4
Small Rings4
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms7
Symmetricatoms2
Amides1
BasicNitrogens2
StereoCon

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