2-[3-[(E)-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetamide

Formula:C21H15N4O4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-[3-[(E)-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetamide is a drug-like molecule.

MolName	2-[3-[(E)-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetamide
MolecularFormula	C21H15N4O4Cl
Smiles	NC(Cn1c(cccc2)c2c(/C=C(\C(NC(N2c(cc3)ccc3Cl)=O)=O)/C2=O)c1)=O
InChI	InChI=1S/C21H15ClN4O4/c22-13-5-7-14(8-6-13)26-20(29)16(19(28)24-21(26)30)9-12-10-25(11-18(23)27)17-4-2-1-3-15(12)17/h1-10H,11H2,(H2,23,27)(H,24,28,30)
InChIK	IZUKUOOETWVPFQ-UHFFFAOYSA-N
TotalMolweight	422.827
Molweight	422.827
MonoisotopicMass	422.078183
CLogP	1.5155
CLogS	-4.367
H Acceptors	8
H Donors	2
TotalSurfaceArea	298.49
Relative PSA	0.29921
PolarSurfaceArea	114.5
Druglikeness	6.6618
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.5
Fragments	1
Non HAtoms	30
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	1
Symmetricatoms	2
Amides	3
Aromatic Nitrogens	1
StereoCon

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