[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] (E)-3-(furan-2-yl)-2-(5-phenyltetrazol-1-yl)prop-2-enoate

Formula:C23H16N5O4F3 Mutagenic:high Tumorigenic:none Reproductive Effective:none [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] (E)-3-(furan-2-yl)-2-(5-phenyltetrazol-1-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] (E)-3-(furan-2-yl)-2-(5-phenyltetrazol-1-yl)prop-2-enoate
MolecularFormula	C23H16N5O4F3
Smiles	O=C(COC(/C(/n1nnnc1-c1ccccc1)=C\c1ccco1)=O)Nc1c(C(F)(F)F)cccc1
InChI	InChI=1S/C23H16F3N5O4/c24-23(25,26)17-10-4-5-11-18(17)27-20(32)14-35-22(33)19(13-16-9-6-12-34-16)31-21(28-29-30-31)15-7-2-1-3-8-15/h1-13H,14H2,(H,27,32)
InChIK	RLKQESOBKKIBSK-UHFFFAOYSA-N
TotalMolweight	483.405
Molweight	483.405
MonoisotopicMass	483.115439
CLogP	3.8286
CLogS	-6.884
H Acceptors	9
H Donors	1
TotalSurfaceArea	352.6
Relative PSA	0.28766
PolarSurfaceArea	112.14
Druglikeness	-4.5446
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.45714
Fragments	1
Non HAtoms	35
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	4
Amides	1
Aromatic Nitrogens	4
StereoCon

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