(E)-3-(4-fluorophenyl)-N-[4-[9-[4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]phenyl]fluoren-9-yl]phenyl]prop-2-enamide

Formula:C43H30N2O2F2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-(4-fluorophenyl)-N-[4-[9-[4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]phenyl]fluoren-9-yl]phenyl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-(4-fluorophenyl)-N-[4-[9-[4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]phenyl]fluoren-9-yl]phenyl]prop-2-enamide
MolecularFormula	C43H30N2O2F2
Smiles	O=C(/C=C/c(cc1)ccc1F)Nc1ccc(C2(c(cccc3)c3-c3c2cccc3)c(cc2)ccc2NC(/C=C/c(cc2)ccc2F)=O)cc1
InChI	InChI=1S/C43H30F2N2O2/c44-33-19-9-29(10-20-33)13-27-41(48)46-35-23-15-31(16-24-35)43(39-7-3-1-5-37(39)38-6-2-4-8-40(38)43)32-17-25-36(26-18-32)47-42(49)28-14-30-11-21-34(45)22-12-30/h1-28H,(H,46,48)(H,47,49)
InChIK	WNAZBOGBZVUVKI-UHFFFAOYSA-N
TotalMolweight	644.719
Molweight	644.719
MonoisotopicMass	644.227534
CLogP	9.1242
CLogS	-14.81
H Acceptors	4
H Donors	2
TotalSurfaceArea	493.09
Relative PSA	0.099373
PolarSurfaceArea	58.2
Druglikeness	-1.5442
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55102
Fragments	1
Non HAtoms	49
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	8
Rings Closures	7
Small Rings	7
Aromatic Rings	6
Aromatic Atoms	36
Sp3Atoms	1
Symmetricatoms	28
Amides	2
StereoCon

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1 - (E)-3-(4-fluorophenyl)-N-[4-[9-[4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]phenyl]fluoren-9-yl]phenyl]prop-2-enamide | 2 - (E)-3-(4-fluorophenyl)-N-[4-[9-[4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]phenyl]fluoren-9-yl]phenyl]prop-2-enamide

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