naphthalen-1-yl N-[(Z)-2,3-dichloroprop-2-enyl]carbamate

Formula:C14H11NO2Cl2 Mutagenic:high Tumorigenic:low Reproductive Effective:high naphthalen-1-yl N-[(Z)-2,3-dichloroprop-2-enyl]carbamate is a drug-like molecule.

MolName	naphthalen-1-yl N-[(Z)-2,3-dichloroprop-2-enyl]carbamate
MolecularFormula	C14H11NO2Cl2
Smiles	O=C(NC/C(/Cl)=C/Cl)Oc1cccc2ccccc12
InChI	InChI=1S/C14H11Cl2NO2/c15-8-11(16)9-17-14(18)19-13-7-3-5-10-4-1-2-6-12(10)13/h1-8H,9H2,(H,17,18)
InChIK	HVXOEZZSRRCJCS-UHFFFAOYSA-N
TotalMolweight	296.152
Molweight	296.152
MonoisotopicMass	295.016683
CLogP	3.8298
CLogS	-5.309
H Acceptors	3
H Donors	1
TotalSurfaceArea	216.38
Relative PSA	0.15944
PolarSurfaceArea	38.33
Druglikeness	-11.408
Mutagenic	high
Tumorigenic	low
Reproductive Effective	high
Irritant	low
Nasty Functions	1,2-dihalo-alkene
Shape Index	0.63158
Fragments	1
Non HAtoms	19
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	2
Amides	1
StereoCon

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