N-[2-[2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide

Formula:C24H23N3O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide is not a drug-like molecule.

MolName	N-[2-[2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide
MolecularFormula	C24H23N3O2S2
Smiles	CCC(Nc(cc1)cc2c1nc(SCC(n1c(cccc3)c3c3c1CCCC3)=O)s2)=O
InChI	InChI=1S/C24H23N3O2S2/c1-2-22(28)25-15-11-12-18-21(13-15)31-24(26-18)30-14-23(29)27-19-9-5-3-7-16(19)17-8-4-6-10-20(17)27/h3,5,7,9,11-13H,2,4,6,8,10,14H2,1H3,(H,25,28)
InChIK	SPJRBRHYEYATOX-UHFFFAOYSA-N
TotalMolweight	449.598
Molweight	449.598
MonoisotopicMass	449.123167
CLogP	5.3884
CLogS	-6.5
H Acceptors	5
H Donors	1
TotalSurfaceArea	331.89
Relative PSA	0.28091
PolarSurfaceArea	117.53
Druglikeness	-0.93767
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54839
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	18
Sp3Atoms	8
Amides	1
Aromatic Nitrogens	2
StereoCon

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1 - N-[2-[2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide | 2 - N-[2-[2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide

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