1-(4-morpholin-4-ylsulfonylphenyl)-3-[(Z)-(3-phenoxyphenyl)methylideneamino]thiourea

Formula:C24H24N4O4S2 Mutagenic:high Tumorigenic:none Reproductive Effective:high 1-(4-morpholin-4-ylsulfonylphenyl)-3-[(Z)-(3-phenoxyphenyl)methylideneamino]thiourea is a drug-like molecule.

MolName	1-(4-morpholin-4-ylsulfonylphenyl)-3-[(Z)-(3-phenoxyphenyl)methylideneamino]thiourea
MolecularFormula	C24H24N4O4S2
Smiles	O=S(c(cc1)ccc1NC(N/N=C\c1cc(Oc2ccccc2)ccc1)=S)(N1CCOCC1)=O
InChI	InChI=1S/C24H24N4O4S2/c29-34(30,28-13-15-31-16-14-28)23-11-9-20(10-12-23)26-24(33)27-25-18-19-5-4-8-22(17-19)32-21-6-2-1-3-7-21/h1-12,17-18H,13-16H2,(H2,26,27,33)
InChIK	QITRUCJZUUIMPG-UHFFFAOYSA-N
TotalMolweight	496.611
Molweight	496.611
MonoisotopicMass	496.123896
CLogP	4.0306
CLogS	-5.824
H Acceptors	8
H Donors	2
TotalSurfaceArea	373.59
Relative PSA	0.30665
PolarSurfaceArea	132.73
Druglikeness	4.3865
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde; thio-amide/urea
Shape Index	0.64706
Fragments	1
Non HAtoms	34
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	8
Symmetricatoms	7
Amides	1
StereoCon

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