[(Z)-(2,4,7-trichloro-5-nitrofluoren-9-ylidene)amino]thiourea

Formula:C14H7N4O2Cl3S Mutagenic:high Tumorigenic:high Reproductive Effective:high [(Z)-(2,4,7-trichloro-5-nitrofluoren-9-ylidene)amino]thiourea is a drug-like molecule.

MolName	[(Z)-(2,4,7-trichloro-5-nitrofluoren-9-ylidene)amino]thiourea
MolecularFormula	C14H7N4O2Cl3S
Smiles	NC(N/N=C(/c1cc(Cl)c2)\c3cc(Cl)cc(Cl)c3-c1c2[N+]([O-])=O)=S
InChI	InChI=1S/C14H7Cl3N4O2S/c15-5-1-7-11(9(17)3-5)12-8(13(7)19-20-14(18)24)2-6(16)4-10(12)21(22)23/h1-4H,(H3,18,20,24)
InChIK	WITJWYIIFMYNAS-UHFFFAOYSA-N
TotalMolweight	401.661
Molweight	401.661
MonoisotopicMass	399.935527
CLogP	4.0114
CLogS	-8.342
H Acceptors	6
H Donors	2
TotalSurfaceArea	265.11
Relative PSA	0.3646
PolarSurfaceArea	128.32
Druglikeness	-3.7993
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro; thio-amide/urea
Shape Index	0.41667
Fragments	1
Non HAtoms	24
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
AcidicOxygens	1
StereoCon

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