N-[(Z)-3-hydrazinyl-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide

Formula:C14H13N3O2S Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-3-hydrazinyl-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide is a drug-like molecule.

MolNameN-[(Z)-3-hydrazinyl-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide
MolecularFormulaC14H13N3O2S
SmilesNNC(/C(/NC(c1ccccc1)=O)=C/c1cccs1)=O
InChIInChI=1S/C14H13N3O2S/c15-17-14(19)12(9-11-7-4-8-20-11)16-13(18)10-5-2-1-3-6-10/h1-9H,15H2,(H,16,18)(H,17,19)
InChIKLEOZOCAJOPAGRO-UHFFFAOYSA-N
TotalMolweight287.342
Molweight287.342
MonoisotopicMass287.072847
CLogP1.4661
CLogS-3.737
H Acceptors5
H Donors3
TotalSurfaceArea220.61
Relative PSA0.38362
PolarSurfaceArea112.46
Druglikeness-1.2231
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionshydrazine
Shape Index0.55
Fragments1
Non HAtoms20
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms1
Symmetricatoms2
Amides1
StereoCon

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