(Z)-2-(3-chlorophenyl)-3-[1-(4-chlorophenyl)pyrrol-2-yl]prop-2-enenitrile

Formula:C19H12N2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-2-(3-chlorophenyl)-3-[1-(4-chlorophenyl)pyrrol-2-yl]prop-2-enenitrile is a drug-like molecule.

MolName	(Z)-2-(3-chlorophenyl)-3-[1-(4-chlorophenyl)pyrrol-2-yl]prop-2-enenitrile
MolecularFormula	C19H12N2Cl2
Smiles	N#C/C(/c1cccc(Cl)c1)=C\c1cccn1-c(cc1)ccc1Cl
InChI	InChI=1S/C19H12Cl2N2/c20-16-6-8-18(9-7-16)23-10-2-5-19(23)12-15(13-22)14-3-1-4-17(21)11-14/h1-12H
InChIK	STULPMFRJNJPGP-UHFFFAOYSA-N
TotalMolweight	339.224
Molweight	339.224
MonoisotopicMass	338.037752
CLogP	4.7835
CLogS	-7.438
H Acceptors	2
TotalSurfaceArea	259.24
Relative PSA	0.078807
PolarSurfaceArea	28.72
Druglikeness	-2.9865
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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