N-[(E)-3-(3-hydroxypropylamino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide

Formula:C19H20N2O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-3-(3-hydroxypropylamino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide is a drug-like molecule.

MolNameN-[(E)-3-(3-hydroxypropylamino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide
MolecularFormulaC19H20N2O3
SmilesOCCCNC(/C(/NC(c1ccccc1)=O)=C\c1ccccc1)=O
InChIInChI=1S/C19H20N2O3/c22-13-7-12-20-19(24)17(14-15-8-3-1-4-9-15)21-18(23)16-10-5-2-6-11-16/h1-6,8-11,14,22H,7,12-13H2,(H,20,24)(H,21,23)
InChIKQMQQCGZRGNQJCQ-UHFFFAOYSA-N
TotalMolweight324.379
Molweight324.379
MonoisotopicMass324.147393
CLogP2.6491
CLogS-3.429
H Acceptors5
H Donors3
TotalSurfaceArea263.78
Relative PSA0.23542
PolarSurfaceArea78.43
Druglikeness1.6304
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.54167
Fragments1
Non HAtoms24
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond7
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms4
Amides2
StereoCon

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