6-[[(E)-3-(2-phenylphenyl)prop-2-enoyl]amino]hexanoic acid

Formula:C21H23NO3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 6-[[(E)-3-(2-phenylphenyl)prop-2-enoyl]amino]hexanoic acid is a drug-like molecule.

MolName	6-[[(E)-3-(2-phenylphenyl)prop-2-enoyl]amino]hexanoic acid
MolecularFormula	C21H23NO3
Smiles	OC(CCCCCNC(/C=C/c(cccc1)c1-c1ccccc1)=O)=O
InChI	InChI=1S/C21H23NO3/c23-20(22-16-8-2-5-13-21(24)25)15-14-18-11-6-7-12-19(18)17-9-3-1-4-10-17/h1,3-4,6-7,9-12,14-15H,2,5,8,13,16H2,(H,22,23)(H,24,25)
InChIK	YMICAAKSZUWZSQ-UHFFFAOYSA-N
TotalMolweight	337.418
Molweight	337.418
MonoisotopicMass	337.167794
CLogP	4.0344
CLogS	-4.932
H Acceptors	4
H Donors	2
TotalSurfaceArea	281.63
Relative PSA	0.17981
PolarSurfaceArea	66.4
Druglikeness	-10.689
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	9
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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