(4-chlorophenyl)methyl N-[[(E)-3-phenylprop-2-enoyl]amino]carbamate

Formula:C17H15N2O3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (4-chlorophenyl)methyl N-[[(E)-3-phenylprop-2-enoyl]amino]carbamate is a drug-like molecule.

MolName	(4-chlorophenyl)methyl N-[[(E)-3-phenylprop-2-enoyl]amino]carbamate
MolecularFormula	C17H15N2O3Cl
Smiles	O=C(/C=C/c1ccccc1)NNC(OCc(cc1)ccc1Cl)=O
InChI	InChI=1S/C17H15ClN2O3/c18-15-9-6-14(7-10-15)12-23-17(22)20-19-16(21)11-8-13-4-2-1-3-5-13/h1-11H,12H2,(H,19,21)(H,20,22)
InChIK	YVUOVFACQPXETD-UHFFFAOYSA-N
TotalMolweight	330.77
Molweight	330.77
MonoisotopicMass	330.07712
CLogP	2.7303
CLogS	-4.884
H Acceptors	5
H Donors	2
TotalSurfaceArea	257.12
Relative PSA	0.22946
PolarSurfaceArea	67.43
Druglikeness	-3.111
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.73913
Fragments	1
Non HAtoms	23
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	4
StereoCon

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