(E)-2-(1,3-benzothiazol-2-yl)-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)prop-2-enenitrile

Formula:C23H18N4OS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-(1,3-benzothiazol-2-yl)-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)prop-2-enenitrile is a drug-like molecule.

MolName	(E)-2-(1,3-benzothiazol-2-yl)-3-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)prop-2-enenitrile
MolecularFormula	C23H18N4OS2
Smiles	N#C/C(/c1nc(cccc2)c2s1)=C\c1c(-c2ccccc2)nc(N2CCOCC2)s1
InChI	InChI=1S/C23H18N4OS2/c24-15-17(22-25-18-8-4-5-9-19(18)29-22)14-20-21(16-6-2-1-3-7-16)26-23(30-20)27-10-12-28-13-11-27/h1-9,14H,10-13H2
InChIK	ZRTMLLPJIAGYBK-UHFFFAOYSA-N
TotalMolweight	430.555
Molweight	430.555
MonoisotopicMass	430.092201
CLogP	4.4665
CLogS	-5.617
H Acceptors	5
TotalSurfaceArea	325.04
Relative PSA	0.27618
PolarSurfaceArea	118.52
Druglikeness	-1.2317
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46667
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	5
Symmetricatoms	4
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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