(E)-1-[4-(3-chloropropoxy)phenyl]-3-phenylprop-2-en-1-one

Formula:C18H17O2Cl Mutagenic:low Tumorigenic:high Reproductive Effective:high (E)-1-[4-(3-chloropropoxy)phenyl]-3-phenylprop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-[4-(3-chloropropoxy)phenyl]-3-phenylprop-2-en-1-one
MolecularFormula	C18H17O2Cl
Smiles	O=C(/C=C/c1ccccc1)c(cc1)ccc1OCCCCl
InChI	InChI=1S/C18H17ClO2/c19-13-4-14-21-17-10-8-16(9-11-17)18(20)12-7-15-5-2-1-3-6-15/h1-3,5-12H,4,13-14H2
InChIK	UYRYKNAEPZCVNX-UHFFFAOYSA-N
TotalMolweight	300.784
Molweight	300.784
MonoisotopicMass	300.091707
CLogP	4.3238
CLogS	-4.829
H Acceptors	2
TotalSurfaceArea	243.97
Relative PSA	0.094438
PolarSurfaceArea	26.3
Druglikeness	-2.415
Mutagenic	low
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.7619
Fragments	1
Non HAtoms	21
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	4
StereoCon

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