(Z)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-2-(3-nitrophenyl)prop-2-enenitrile

Formula:C19H10N2O3Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (Z)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-2-(3-nitrophenyl)prop-2-enenitrile is a drug-like molecule.

MolName	(Z)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-2-(3-nitrophenyl)prop-2-enenitrile
MolecularFormula	C19H10N2O3Cl2
Smiles	N#C/C(/c1cc([N+]([O-])=O)ccc1)=C\c1ccc(-c(cc2)cc(Cl)c2Cl)o1
InChI	InChI=1S/C19H10Cl2N2O3/c20-17-6-4-13(10-18(17)21)19-7-5-16(26-19)9-14(11-22)12-2-1-3-15(8-12)23(24)25/h1-10H
InChIK	AUHJILWGNRHBES-UHFFFAOYSA-N
TotalMolweight	385.205
Molweight	385.205
MonoisotopicMass	384.006847
CLogP	4.5619
CLogS	-7.021
H Acceptors	5
TotalSurfaceArea	283.4
Relative PSA	0.20498
PolarSurfaceArea	82.75
Druglikeness	-8.5642
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
AcidicOxygens	1
StereoCon

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