(2Z)-2-[[2-(3-phenoxypropoxy)phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one

Formula:C25H20N2O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (2Z)-2-[[2-(3-phenoxypropoxy)phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one is not a drug-like molecule.

MolName	(2Z)-2-[[2-(3-phenoxypropoxy)phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
MolecularFormula	C25H20N2O3S
Smiles	O=C(/C(/S1)=C/c(cccc2)c2OCCCOc2ccccc2)n2c1nc1c2cccc1
InChI	InChI=1S/C25H20N2O3S/c28-24-23(31-25-26-20-12-5-6-13-21(20)27(24)25)17-18-9-4-7-14-22(18)30-16-8-15-29-19-10-2-1-3-11-19/h1-7,9-14,17H,8,15-16H2
InChIK	DZZKKRCEXBRITM-UHFFFAOYSA-N
TotalMolweight	428.511
Molweight	428.511
MonoisotopicMass	428.119463
CLogP	5.3156
CLogS	-5.673
H Acceptors	5
TotalSurfaceArea	323.07
Relative PSA	0.21163
PolarSurfaceArea	78.65
Druglikeness	2.8903
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	6
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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