(4R)-3'-[(4-pyridin-2-ylpiperazin-1-yl)methyl]spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione

Formula:C22H25N5O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4R)-3'-[(4-pyridin-2-ylpiperazin-1-yl)methyl]spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione is a drug-like molecule.

MolName	(4R)-3'-[(4-pyridin-2-ylpiperazin-1-yl)methyl]spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione
MolecularFormula	C22H25N5O2
Smiles	O=C([C@@](CCC1)(c2c1cccc2)N1)N(CN(CC2)CCN2c2ncccc2)C1=O
InChI	InChI=1S/C22H25N5O2/c28-20-22(10-5-7-17-6-1-2-8-18(17)22)24-21(29)27(20)16-25-12-14-26(15-13-25)19-9-3-4-11-23-19/h1-4,6,8-9,11H,5,7,10,12-16H2,(H,24,29)/t22-/m1/s1
InChIK	BLBWTZXPHAXSEA-JOCHJYFZSA-N
TotalMolweight	391.474
Molweight	391.474
MonoisotopicMass	391.200825
CLogP	2.1211
CLogS	-3.589
H Acceptors	7
H Donors	1
TotalSurfaceArea	289.63
Relative PSA	0.20426
PolarSurfaceArea	68.78
Druglikeness	4.7806
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	methanediamine
Shape Index	0.55172
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	1
BasicNitrogens	2
StereoCon	this enantiomer

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1 - (4R)-3'-[(4-pyridin-2-ylpiperazin-1-yl)methyl]spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione | 2 - (4R)-3'-[(4-pyridin-2-ylpiperazin-1-yl)methyl]spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione

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