3-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]benzoate

Formula:C17H9N2O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]benzoate is a drug-like molecule.

MolName	3-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]benzoate
MolecularFormula	C17H9N2O3S
Smiles	[O-]C(c1cccc(/C=C2\Sc3nc(cccc4)c4n3C2=O)c1)=O
InChI	InChI=1S/C17H10N2O3S/c20-15-14(9-10-4-3-5-11(8-10)16(21)22)23-17-18-12-6-1-2-7-13(12)19(15)17/h1-9H,(H,21,22)/p-1
InChIK	RHNFNWGBHCMFSH-UHFFFAOYSA-M
TotalMolweight	321.335
Molweight	321.335
MonoisotopicMass	321.033388
CLogP	0.9153
CLogS	-4.148
H Acceptors	5
TotalSurfaceArea	227.31
Relative PSA	0.33298
PolarSurfaceArea	100.32
Druglikeness	3.4665
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	2
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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