6-[[(E)-2-benzamido-3-phenylprop-2-enoyl]amino]hexanoic acid

Formula:C22H24N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 6-[[(E)-2-benzamido-3-phenylprop-2-enoyl]amino]hexanoic acid is a drug-like molecule.

MolName	6-[[(E)-2-benzamido-3-phenylprop-2-enoyl]amino]hexanoic acid
MolecularFormula	C22H24N2O4
Smiles	OC(CCCCCNC(/C(/NC(c1ccccc1)=O)=C\c1ccccc1)=O)=O
InChI	InChI=1S/C22H24N2O4/c25-20(26)14-8-3-9-15-23-22(28)19(16-17-10-4-1-5-11-17)24-21(27)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,23,28)(H,24,27)(H,25,26)
InChIK	IPBZKTMLUNGVIT-UHFFFAOYSA-N
TotalMolweight	380.443
Molweight	380.443
MonoisotopicMass	380.173608
CLogP	3.6627
CLogS	-4.221
H Acceptors	6
H Donors	3
TotalSurfaceArea	309.05
Relative PSA	0.24313
PolarSurfaceArea	95.5
Druglikeness	-7.5839
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	10
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	4
Amides	2
AcidicOxygens	1
StereoCon

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