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

Formula:C27H16N2O3S Mutagenic:low Tumorigenic:high Reproductive Effective:none [3-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]phenyl] naphthalene-1-carboxylate is not a drug-like molecule.

MolName	[3-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]phenyl] naphthalene-1-carboxylate
MolecularFormula	C27H16N2O3S
Smiles	O=C(c1cccc2ccccc12)Oc1cccc(/C=C2\Sc3nc(cccc4)c4n3C2=O)c1
InChI	InChI=1S/C27H16N2O3S/c30-25-24(33-27-28-22-13-3-4-14-23(22)29(25)27)16-17-7-5-10-19(15-17)32-26(31)21-12-6-9-18-8-1-2-11-20(18)21/h1-16H
InChIK	ZEIGEGUMYJMJKH-UHFFFAOYSA-N
TotalMolweight	448.501
Molweight	448.501
MonoisotopicMass	448.088163
CLogP	6.1311
CLogS	-7.211
H Acceptors	5
TotalSurfaceArea	324.14
Relative PSA	0.22031
PolarSurfaceArea	86.49
Druglikeness	3.2388
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	6
Small Rings	6
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	2
Aromatic Nitrogens	2
StereoCon

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