2-[4-[[(E)-3-naphthalen-2-yl-3-oxoprop-1-enyl]amino]phenyl]sulfonylguanidine

Formula:C20H18N4O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[4-[[(E)-3-naphthalen-2-yl-3-oxoprop-1-enyl]amino]phenyl]sulfonylguanidine is a drug-like molecule.

MolName	2-[4-[[(E)-3-naphthalen-2-yl-3-oxoprop-1-enyl]amino]phenyl]sulfonylguanidine
MolecularFormula	C20H18N4O3S
Smiles	NC(N)=NS(c(cc1)ccc1N/C=C/C(c1cc2ccccc2cc1)=O)(=O)=O
InChI	InChI=1S/C20H18N4O3S/c21-20(22)24-28(26,27)18-9-7-17(8-10-18)23-12-11-19(25)16-6-5-14-3-1-2-4-15(14)13-16/h1-13,23H,(H4,21,22,24)
InChIK	XJEJKDAXHRTFNU-UHFFFAOYSA-N
TotalMolweight	394.454
Molweight	394.454
MonoisotopicMass	394.109961
CLogP	1.8925
CLogS	-5.666
H Acceptors	7
H Donors	3
TotalSurfaceArea	291.92
Relative PSA	0.32588
PolarSurfaceArea	136.02
Druglikeness	0.64998
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64286
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	1
Symmetricatoms	4
BasicNitrogens	1
StereoCon

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1 - 2-[4-[[(E)-3-naphthalen-2-yl-3-oxoprop-1-enyl]amino]phenyl]sulfonylguanidine | 2 - 2-[4-[[(E)-3-naphthalen-2-yl-3-oxoprop-1-enyl]amino]phenyl]sulfonylguanidine

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