(E)-2-[(2,2-diphenylacetyl)amino]-N-(3-hydroxypropyl)-3-phenylprop-2-enamide

Formula:C26H26N2O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-[(2,2-diphenylacetyl)amino]-N-(3-hydroxypropyl)-3-phenylprop-2-enamide is a drug-like molecule.

MolName(E)-2-[(2,2-diphenylacetyl)amino]-N-(3-hydroxypropyl)-3-phenylprop-2-enamide
MolecularFormulaC26H26N2O3
SmilesOCCCNC(/C(/NC(C(c1ccccc1)c1ccccc1)=O)=C\c1ccccc1)=O
InChIInChI=1S/C26H26N2O3/c29-18-10-17-27-25(30)23(19-20-11-4-1-5-12-20)28-26(31)24(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-9,11-16,19,24,29H,10,17-18H2,(H,27,30)(H,28,31)
InChIKGUHVDSBBIAUFPJ-UHFFFAOYSA-N
TotalMolweight414.503
Molweight414.503
MonoisotopicMass414.194343
CLogP4.1748
CLogS-4.543
H Acceptors5
H Donors3
TotalSurfaceArea336.04
Relative PSA0.1848
PolarSurfaceArea78.43
Druglikeness2.7217
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.45161
Fragments1
Non HAtoms31
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond9
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms5
Symmetricatoms10
Amides2
StereoCon

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