4-(4-cyclohexylpiperazin-1-yl)-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide

Formula:C20H28N6O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-(4-cyclohexylpiperazin-1-yl)-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide is a drug-like molecule.

MolName	4-(4-cyclohexylpiperazin-1-yl)-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide
MolecularFormula	C20H28N6O3
Smiles	O=C(CCC(N(CC1)CCN1C1CCCCC1)=O)Nc(cc1)nc(N2)c1NC2=O
InChI	InChI=1S/C20H28N6O3/c27-17(22-16-7-6-15-19(23-16)24-20(29)21-15)8-9-18(28)26-12-10-25(11-13-26)14-4-2-1-3-5-14/h6-7,14H,1-5,8-13H2,(H3,21,22,23,24,27,29)
InChIK	ZADDFDJZUPNBQM-UHFFFAOYSA-N
TotalMolweight	400.481
Molweight	400.481
MonoisotopicMass	400.222289
CLogP	1.4437
CLogS	-3.943
H Acceptors	9
H Donors	3
TotalSurfaceArea	303.61
Relative PSA	0.3016
PolarSurfaceArea	106.67
Druglikeness	1.8886
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	13
Symmetricatoms	4
Amides	4
Amines	1
AlkylAmines	1
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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