(Z)-3-(4-chloro-3-nitrophenyl)-2-phenylprop-2-enoic acid

Formula:C15H10NO4Cl Mutagenic:none Tumorigenic:low Reproductive Effective:high (Z)-3-(4-chloro-3-nitrophenyl)-2-phenylprop-2-enoic acid is a drug-like molecule.

MolName	(Z)-3-(4-chloro-3-nitrophenyl)-2-phenylprop-2-enoic acid
MolecularFormula	C15H10NO4Cl
Smiles	[O-][N+](c(cc(/C=C(\C(O)=O)/c1ccccc1)cc1)c1Cl)=O
InChI	InChI=1S/C15H10ClNO4/c16-13-7-6-10(9-14(13)17(20)21)8-12(15(18)19)11-4-2-1-3-5-11/h1-9H,(H,18,19)
InChIK	PKXMAFZOSSKMAN-UHFFFAOYSA-N
TotalMolweight	303.7
Molweight	303.7
MonoisotopicMass	303.029836
CLogP	2.4951
CLogS	-4.152
H Acceptors	5
H Donors	1
TotalSurfaceArea	220.92
Relative PSA	0.25602
PolarSurfaceArea	83.12
Druglikeness	-4.6722
Mutagenic	none
Tumorigenic	low
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.52381
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
AcidicOxygens	2
StereoCon

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