(E)-3-(furan-2-yl)-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

Formula:C19H9N3O5S Mutagenic:high Tumorigenic:none Reproductive Effective:none (E)-3-(furan-2-yl)-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile is a drug-like molecule.

MolName	(E)-3-(furan-2-yl)-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
MolecularFormula	C19H9N3O5S
Smiles	N#C/C(/c1nc(C2=Cc(cc(cc3)[N+]([O-])=O)c3OC2=O)cs1)=C\c1ccco1
InChI	InChI=1S/C19H9N3O5S/c20-9-12(7-14-2-1-5-26-14)18-21-16(10-28-18)15-8-11-6-13(22(24)25)3-4-17(11)27-19(15)23/h1-8,10H
InChIK	QZOIDLBNORPBRJ-UHFFFAOYSA-N
TotalMolweight	391.362
Molweight	391.362
MonoisotopicMass	391.026292
CLogP	1.5768
CLogS	-4.536
H Acceptors	8
TotalSurfaceArea	286.22
Relative PSA	0.39291
PolarSurfaceArea	150.18
Druglikeness	-6.4832
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53571
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	2
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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