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

Formula:C27H24N3O4Cl Mutagenic:high Tumorigenic:high Reproductive Effective:none 3-[[4-chloro-1-(2-methoxy-5-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(4-ethylphenyl)benzamide is a drug-like molecule.

MolName	3-[[4-chloro-1-(2-methoxy-5-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(4-ethylphenyl)benzamide
MolecularFormula	C27H24N3O4Cl
Smiles	CCc(cc1)ccc1NC(c1cccc(NC(C(N(C2=O)c(cc(C)cc3)c3OC)=O)=C2Cl)c1)=O
InChI	InChI=1S/C27H24ClN3O4/c1-4-17-9-11-19(12-10-17)30-25(32)18-6-5-7-20(15-18)29-24-23(28)26(33)31(27(24)34)21-14-16(2)8-13-22(21)35-3/h5-15,29H,4H2,1-3H3,(H,30,32)
InChIK	HTGUYMHNDKRYLD-UHFFFAOYSA-N
TotalMolweight	489.958
Molweight	489.958
MonoisotopicMass	489.145534
CLogP	4.5056
CLogS	-6.572
H Acceptors	7
H Donors	2
TotalSurfaceArea	364.63
Relative PSA	0.20731
PolarSurfaceArea	87.74
Druglikeness	2.0245
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	2-halo-enone; 3-halo-enone
Shape Index	0.54286
Fragments	1
Non HAtoms	35
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	5
Symmetricatoms	2
Amides	2
StereoCon

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