4-bromo-N-[4-[[4-[(E)-2-(4-chlorophenyl)ethenyl]pyrimidin-2-yl]sulfamoyl]phenyl]benzamide

Formula:C25H18N4O3BrClS Mutagenic:low Tumorigenic:none Reproductive Effective:none 4-bromo-N-[4-[[4-[(E)-2-(4-chlorophenyl)ethenyl]pyrimidin-2-yl]sulfamoyl]phenyl]benzamide is not a drug-like molecule.

MolName	4-bromo-N-[4-[[4-[(E)-2-(4-chlorophenyl)ethenyl]pyrimidin-2-yl]sulfamoyl]phenyl]benzamide
MolecularFormula	C25H18N4O3BrClS
Smiles	O=C(c(cc1)ccc1Br)Nc(cc1)ccc1S(Nc1nc(/C=C/c(cc2)ccc2Cl)ccn1)(=O)=O
InChI	InChI=1S/C25H18BrClN4O3S/c26-19-6-4-18(5-7-19)24(32)29-21-11-13-23(14-12-21)35(33,34)31-25-28-16-15-22(30-25)10-3-17-1-8-20(27)9-2-17/h1-16H,(H,29,32)(H,28,30,31)
InChIK	BXLGTAGJZSZDBT-UHFFFAOYSA-N
TotalMolweight	569.866
Molweight	569.866
MonoisotopicMass	567.997149
CLogP	5.5047
CLogS	-7.458
H Acceptors	7
H Donors	2
TotalSurfaceArea	379.86
Relative PSA	0.22766
PolarSurfaceArea	109.43
Druglikeness	1.9098
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65714
Fragments	1
Non HAtoms	35
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	1
Symmetricatoms	7
Amides	2
Aromatic Nitrogens	2
StereoCon

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