N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[[(E)-3-[4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enoyl]amino]piperidine-4-carboxamide

Formula:C32H32N4O3F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[[(E)-3-[4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enoyl]amino]piperidine-4-carboxamide is not a drug-like molecule.

MolName	N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[[(E)-3-[4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enoyl]amino]piperidine-4-carboxamide
MolecularFormula	C32H32N4O3F2
Smiles	O=C(C1(CCNCC1)NC(/C=C/c(cc1)ccc1OCc(cc1)ccc1F)=O)NCCc1c[nH]c(cc2)c1cc2F
InChI	InChI=1S/C32H32F2N4O3/c33-25-6-1-23(2-7-25)21-41-27-9-3-22(4-10-27)5-12-30(39)38-32(14-17-35-18-15-32)31(40)36-16-13-24-20-37-29-11-8-26(34)19-28(24)29/h1-12,19-20,35,37H,13-18,21H2,(H,36,40)(H,38,39)
InChIK	YHSGYGVVJOFKMR-UHFFFAOYSA-N
TotalMolweight	558.627
Molweight	558.627
MonoisotopicMass	558.244247
CLogP	4.0885
CLogS	-6.045
H Acceptors	7
H Donors	4
TotalSurfaceArea	429.26
Relative PSA	0.19673
PolarSurfaceArea	95.25
Druglikeness	1.6121
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.60976
Fragments	1
Non HAtoms	41
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	10
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	10
Symmetricatoms	6
Amides	2
Amines	1
AlkylAmines	1
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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1 - N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[[(E)-3-[4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enoyl]amino]piperidine-4-carboxamide | 2 - N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[[(E)-3-[4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enoyl]amino]piperidine-4-carboxamide

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