[2-(2,4-difluoroanilino)-2-oxoethyl] (E)-3-(5-bromofuran-2-yl)prop-2-enoate

Formula:C15H10NO4BrF2 Mutagenic:high Tumorigenic:high Reproductive Effective:none [2-(2,4-difluoroanilino)-2-oxoethyl] (E)-3-(5-bromofuran-2-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-(2,4-difluoroanilino)-2-oxoethyl] (E)-3-(5-bromofuran-2-yl)prop-2-enoate
MolecularFormula	C15H10NO4BrF2
Smiles	O=C(COC(/C=C/c(o1)ccc1Br)=O)Nc(ccc(F)c1)c1F
InChI	InChI=1S/C15H10BrF2NO4/c16-13-5-2-10(23-13)3-6-15(21)22-8-14(20)19-12-4-1-9(17)7-11(12)18/h1-7H,8H2,(H,19,20)
InChIK	RJZLZWOMGVISDK-UHFFFAOYSA-N
TotalMolweight	386.147
Molweight	386.147
MonoisotopicMass	384.976126
CLogP	2.9071
CLogS	-4.308
H Acceptors	5
H Donors	1
TotalSurfaceArea	251.26
Relative PSA	0.24536
PolarSurfaceArea	68.54
Druglikeness	-3.355
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.69565
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Amides	1
StereoCon

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