3-[[4-chloro-1-(2-methoxy-5-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(4-sulfamoylphenyl)benzamide

Formula:C25H21N4O6ClS Mutagenic:high Tumorigenic:high Reproductive Effective:none 3-[[4-chloro-1-(2-methoxy-5-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(4-sulfamoylphenyl)benzamide is not a drug-like molecule.

MolName	3-[[4-chloro-1-(2-methoxy-5-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(4-sulfamoylphenyl)benzamide
MolecularFormula	C25H21N4O6ClS
Smiles	Cc(cc1)cc(N(C(C(Nc2cc(C(Nc(cc3)ccc3S(N)(=O)=O)=O)ccc2)=C2Cl)=O)C2=O)c1OC
InChI	InChI=1S/C25H21ClN4O6S/c1-14-6-11-20(36-2)19(12-14)30-24(32)21(26)22(25(30)33)28-17-5-3-4-15(13-17)23(31)29-16-7-9-18(10-8-16)37(27,34)35/h3-13,28H,1-2H3,(H,29,31)(H2,27,34,35)
InChIK	CNGCEPQSZLFVQI-UHFFFAOYSA-N
TotalMolweight	540.983
Molweight	540.983
MonoisotopicMass	540.087033
CLogP	2.5101
CLogS	-5.968
H Acceptors	10
H Donors	3
TotalSurfaceArea	375.71
Relative PSA	0.3179
PolarSurfaceArea	156.28
Druglikeness	3.3625
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	2-halo-enone; 3-halo-enone
Shape Index	0.51351
Fragments	1
Non HAtoms	37
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	3
Amides	3
StereoCon

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