4-nitro-N-[(Z)-[2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzo[f]chromen-3-ylidene]amino]aniline

Formula:C28H17N5O5S Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-nitro-N-[(Z)-[2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzo[f]chromen-3-ylidene]amino]aniline is not a drug-like molecule.

MolName	4-nitro-N-[(Z)-[2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzo[f]chromen-3-ylidene]amino]aniline
MolecularFormula	C28H17N5O5S
Smiles	[O-][N+](c(cc1)ccc1-c1csc(C2=Cc(c3ccccc3cc3)c3O/C2=N\Nc(cc2)ccc2[N+]([O-])=O)n1)=O
InChI	InChI=1S/C28H17N5O5S/c34-32(35)20-10-5-18(6-11-20)25-16-39-28(29-25)24-15-23-22-4-2-1-3-17(22)7-14-26(23)38-27(24)31-30-19-8-12-21(13-9-19)33(36)37/h1-16,30H
InChIK	XHYWUVDCZJCEAQ-UHFFFAOYSA-N
TotalMolweight	535.539
Molweight	535.539
MonoisotopicMass	535.09504
CLogP	5.9321
CLogS	-7.87
H Acceptors	10
H Donors	1
TotalSurfaceArea	384.82
Relative PSA	0.32519
PolarSurfaceArea	166.39
Druglikeness	-1.16
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.48718
Fragments	1
Non HAtoms	39
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	6
Small Rings	6
Aromatic Rings	5
Aromatic Atoms	27
Sp3Atoms	3
Symmetricatoms	4
Aromatic Nitrogens	1
AcidicOxygens	2
StereoCon

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