(E)-3-[4-[(2-chlorophenyl)methoxy]phenyl]-2-cyano-N-cyclopentylprop-2-enamide

Formula:C22H21N2O2Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[4-[(2-chlorophenyl)methoxy]phenyl]-2-cyano-N-cyclopentylprop-2-enamide is a drug-like molecule.

MolName	(E)-3-[4-[(2-chlorophenyl)methoxy]phenyl]-2-cyano-N-cyclopentylprop-2-enamide
MolecularFormula	C22H21N2O2Cl
Smiles	N#C/C(/C(NC1CCCC1)=O)=C\c(cc1)ccc1OCc(cccc1)c1Cl
InChI	InChI=1S/C22H21ClN2O2/c23-21-8-4-1-5-17(21)15-27-20-11-9-16(10-12-20)13-18(14-24)22(26)25-19-6-2-3-7-19/h1,4-5,8-13,19H,2-3,6-7,15H2,(H,25,26)
InChIK	VYVRTRJXZIKDMH-UHFFFAOYSA-N
TotalMolweight	380.874
Molweight	380.874
MonoisotopicMass	380.129155
CLogP	4.4474
CLogS	-5.644
H Acceptors	4
H Donors	1
TotalSurfaceArea	301.87
Relative PSA	0.15921
PolarSurfaceArea	62.12
Druglikeness	-3.645
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.62963
Fragments	1
Non HAtoms	27
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	4
Amides	1
StereoCon

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