3-(furan-2-yl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole

Formula:C19H15N3O4 Mutagenic:high Tumorigenic:high Reproductive Effective:none 3-(furan-2-yl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole is a drug-like molecule.

MolName	3-(furan-2-yl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole
MolecularFormula	C19H15N3O4
Smiles	[O-][N+](c1ccc(/C=C/C(CC2c3ccco3)=NN2c2ccccc2)o1)=O
InChI	InChI=1S/C19H15N3O4/c23-22(24)19-11-10-16(26-19)9-8-14-13-17(18-7-4-12-25-18)21(20-14)15-5-2-1-3-6-15/h1-12,17H,13H2/t17-/m1/s1
InChIK	PEYAYDLYYOQRKF-QGZVFWFLSA-N
TotalMolweight	349.345
Molweight	349.345
MonoisotopicMass	349.106257
CLogP	3.4792
CLogS	-5.044
H Acceptors	7
TotalSurfaceArea	268.36
Relative PSA	0.27463
PolarSurfaceArea	87.7
Druglikeness	-0.61969
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	3
Symmetricatoms	2
AcidicOxygens	1
StereoCon	racemate

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