1-(4-chlorophenyl)-8-nitroso-2,4-diphenyl-6,7-dihydro-5H-quinoline

Formula:C27H21N2OCl Mutagenic:high Tumorigenic:high Reproductive Effective:none 1-(4-chlorophenyl)-8-nitroso-2,4-diphenyl-6,7-dihydro-5H-quinoline is not a drug-like molecule.

MolName	1-(4-chlorophenyl)-8-nitroso-2,4-diphenyl-6,7-dihydro-5H-quinoline
MolecularFormula	C27H21N2OCl
Smiles	O=NC1=C2N(c(cc3)ccc3Cl)C(c3ccccc3)=CC(c3ccccc3)=C2CCC1
InChI	InChI=1S/C27H21ClN2O/c28-21-14-16-22(17-15-21)30-26(20-10-5-2-6-11-20)18-24(19-8-3-1-4-9-19)23-12-7-13-25(29-31)27(23)30/h1-6,8-11,14-18H,7,12-13H2
InChIK	DPOCBWAJHDVGBS-UHFFFAOYSA-N
TotalMolweight	424.93
Molweight	424.93
MonoisotopicMass	424.13424
CLogP	6.2374
CLogS	-6.683
H Acceptors	3
TotalSurfaceArea	321.13
Relative PSA	0.087504
PolarSurfaceArea	32.67
Druglikeness	-2.2302
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	nitroso
Shape Index	0.41935
Fragments	1
Non HAtoms	31
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	6
StereoCon

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