(E)-1-(3-nitrophenyl)-3-(2-phenyl-1H-indol-3-yl)prop-2-en-1-one

Formula:C23H16N2O3 Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-1-(3-nitrophenyl)-3-(2-phenyl-1H-indol-3-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-(3-nitrophenyl)-3-(2-phenyl-1H-indol-3-yl)prop-2-en-1-one
MolecularFormula	C23H16N2O3
Smiles	[O-][N+](c1cc(C(/C=C/c2c(-c3ccccc3)[nH]c3c2cccc3)=O)ccc1)=O
InChI	InChI=1S/C23H16N2O3/c26-22(17-9-6-10-18(15-17)25(27)28)14-13-20-19-11-4-5-12-21(19)24-23(20)16-7-2-1-3-8-16/h1-15,24H
InChIK	QJKLAKFYCQIUPE-UHFFFAOYSA-N
TotalMolweight	368.391
Molweight	368.391
MonoisotopicMass	368.116093
CLogP	4.1718
CLogS	-6.603
H Acceptors	5
H Donors	1
TotalSurfaceArea	284.87
Relative PSA	0.20167
PolarSurfaceArea	78.68
Druglikeness	-3.6158
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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