2-[(Z)-(10-chloroanthracen-9-yl)methylideneamino]-1-hydroxyguanidine

Formula:C16H13N4OCl Mutagenic:low Tumorigenic:high Reproductive Effective:low 2-[(Z)-(10-chloroanthracen-9-yl)methylideneamino]-1-hydroxyguanidine is a drug-like molecule.

MolName	2-[(Z)-(10-chloroanthracen-9-yl)methylideneamino]-1-hydroxyguanidine
MolecularFormula	C16H13N4OCl
Smiles	N/C(/NO)=N/N=C\c(c1ccccc11)c(cccc2)c2c1Cl
InChI	InChI=1S/C16H13ClN4O/c17-15-12-7-3-1-5-10(12)14(9-19-20-16(18)21-22)11-6-2-4-8-13(11)15/h1-9,22H,(H3,18,20,21)
InChIK	FCVGMMMRBFYCTL-UHFFFAOYSA-N
TotalMolweight	312.759
Molweight	312.759
MonoisotopicMass	312.077788
CLogP	4.7515
CLogS	-7.137
H Acceptors	5
H Donors	3
TotalSurfaceArea	231.94
Relative PSA	0.27098
PolarSurfaceArea	83
Druglikeness	1.8275
Mutagenic	low
Tumorigenic	high
Reproductive Effective	low
Irritant	high
Nasty Functions	dimethylene-hydrazine; imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	14
Sp3Atoms	2
Symmetricatoms	6
BasicNitrogens	1
StereoCon

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