2-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylethyl (E)-3-(furan-2-yl)prop-2-enoate

Formula:C17H18N2O6S2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylethyl (E)-3-(furan-2-yl)prop-2-enoate is a drug-like molecule.

MolName	2-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylethyl (E)-3-(furan-2-yl)prop-2-enoate
MolecularFormula	C17H18N2O6S2
Smiles	NS(c(cc1)ccc1NC(CSCCOC(/C=C/c1ccco1)=O)=O)(=O)=O
InChI	InChI=1S/C17H18N2O6S2/c18-27(22,23)15-6-3-13(4-7-15)19-16(20)12-26-11-10-25-17(21)8-5-14-2-1-9-24-14/h1-9H,10-12H2,(H,19,20)(H2,18,22,23)
InChIK	YUBKOUQTQSVQDM-UHFFFAOYSA-N
TotalMolweight	410.47
Molweight	410.47
MonoisotopicMass	410.060628
CLogP	1.2931
CLogS	-3.589
H Acceptors	8
H Donors	2
TotalSurfaceArea	302.04
Relative PSA	0.4072
PolarSurfaceArea	162.38
Druglikeness	2.228
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.7037
Fragments	1
Non HAtoms	27
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	10
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	6
Symmetricatoms	3
Amides	2
StereoCon

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