(Z)-3-(5-bromofuran-2-yl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide

Formula:C18H14N3O2Br Mutagenic:high Tumorigenic:high Reproductive Effective:none (Z)-3-(5-bromofuran-2-yl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide is a drug-like molecule.

MolName	(Z)-3-(5-bromofuran-2-yl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
MolecularFormula	C18H14N3O2Br
Smiles	N#C/C(/C(NCCc1c[nH]c2c1cccc2)=O)=C/c(o1)ccc1Br
InChI	InChI=1S/C18H14BrN3O2/c19-17-6-5-14(24-17)9-13(10-20)18(23)21-8-7-12-11-22-16-4-2-1-3-15(12)16/h1-6,9,11,22H,7-8H2,(H,21,23)
InChIK	ASDDFCXVSCOVKX-UHFFFAOYSA-N
TotalMolweight	384.232
Molweight	384.232
MonoisotopicMass	383.026938
CLogP	3.1785
CLogS	-4.502
H Acceptors	5
H Donors	2
TotalSurfaceArea	268.66
Relative PSA	0.24626
PolarSurfaceArea	81.82
Druglikeness	-3.3286
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	14
Sp3Atoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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