(E)-3-anthracen-9-yl-2-[4-(furan-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

Formula:C24H14N2OS Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-anthracen-9-yl-2-[4-(furan-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile is not a drug-like molecule.

MolName	(E)-3-anthracen-9-yl-2-[4-(furan-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
MolecularFormula	C24H14N2OS
Smiles	N#C/C(/c1nc(-c2ccco2)cs1)=C\c1c(cccc2)c2cc2ccccc12
InChI	InChI=1S/C24H14N2OS/c25-14-18(24-26-22(15-28-24)23-10-5-11-27-23)13-21-19-8-3-1-6-16(19)12-17-7-2-4-9-20(17)21/h1-13,15H
InChIK	SBMDWECUYUNXRN-UHFFFAOYSA-N
TotalMolweight	378.454
Molweight	378.454
MonoisotopicMass	378.082683
CLogP	5.5274
CLogS	-6.999
H Acceptors	3
TotalSurfaceArea	292.79
Relative PSA	0.20151
PolarSurfaceArea	78.06
Druglikeness	-1.9922
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.46429
Fragments	1
Non HAtoms	28
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	24
Symmetricatoms	6
Aromatic Nitrogens	1
StereoCon

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