1-(3,4-dichlorophenyl)-3-[4-[[4-[(E)-2-(2-fluorophenyl)ethenyl]pyrimidin-2-yl]sulfamoyl]phenyl]urea

Formula:C25H18N5O3Cl2FS Mutagenic:none Tumorigenic:none Reproductive Effective:low 1-(3,4-dichlorophenyl)-3-[4-[[4-[(E)-2-(2-fluorophenyl)ethenyl]pyrimidin-2-yl]sulfamoyl]phenyl]urea is not a drug-like molecule.

MolName	1-(3,4-dichlorophenyl)-3-[4-[[4-[(E)-2-(2-fluorophenyl)ethenyl]pyrimidin-2-yl]sulfamoyl]phenyl]urea
MolecularFormula	C25H18N5O3Cl2FS
Smiles	O=C(Nc(cc1)ccc1S(Nc1nc(/C=C/c(cccc2)c2F)ccn1)(=O)=O)Nc(cc1)cc(Cl)c1Cl
InChI	InChI=1S/C25H18Cl2FN5O3S/c26-21-12-9-19(15-22(21)27)32-25(34)31-17-7-10-20(11-8-17)37(35,36)33-24-29-14-13-18(30-24)6-5-16-3-1-2-4-23(16)28/h1-15H,(H,29,30,33)(H2,31,32,34)
InChIK	XFFDOXUEUDCECZ-UHFFFAOYSA-N
TotalMolweight	558.42
Molweight	558.42
MonoisotopicMass	557.049142
CLogP	5.4802
CLogS	-8.19
H Acceptors	8
H Donors	3
TotalSurfaceArea	394.46
Relative PSA	0.24829
PolarSurfaceArea	121.46
Druglikeness	2.1663
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.62162
Fragments	1
Non HAtoms	37
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	1
Symmetricatoms	3
Amides	3
Aromatic Nitrogens	2
StereoCon

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