(2R)-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate

Formula:C20H16N2O3F Mutagenic:none Tumorigenic:none Reproductive Effective:none (2R)-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate is a drug-like molecule.

MolName	(2R)-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate
MolecularFormula	C20H16N2O3F
Smiles	[O-]C([C@@H](Cc1c[nH]c2c1cccc2)NC(/C=C/c(cc1)ccc1F)=O)=O
InChI	InChI=1S/C20H17FN2O3/c21-15-8-5-13(6-9-15)7-10-19(24)23-18(20(25)26)11-14-12-22-17-4-2-1-3-16(14)17/h1-10,12,18,22H,11H2,(H,23,24)(H,25,26)/p-1/t18-/m1/s1
InChIK	KZVWMLMJQYTQQL-GOSISDBHSA-M
TotalMolweight	351.356
Molweight	351.356
MonoisotopicMass	351.114496
CLogP	0.423
CLogS	-4.118
H Acceptors	5
H Donors	2
TotalSurfaceArea	270.79
Relative PSA	0.24303
PolarSurfaceArea	85.02
Druglikeness	0.98167
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	3
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon	this enantiomer

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1 - (2R)-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate | 2 - (2R)-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate

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