4-chloro-3-[5-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]furan-2-yl]benzoic acid

Formula:C21H11N2O4ClS Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-chloro-3-[5-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]furan-2-yl]benzoic acid is a drug-like molecule.

MolName	4-chloro-3-[5-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]furan-2-yl]benzoic acid
MolecularFormula	C21H11N2O4ClS
Smiles	OC(c(cc1)cc(-c2ccc(/C=C3\Sc4nc(cccc5)c5n4C3=O)o2)c1Cl)=O
InChI	InChI=1S/C21H11ClN2O4S/c22-14-7-5-11(20(26)27)9-13(14)17-8-6-12(28-17)10-18-19(25)24-16-4-2-1-3-15(16)23-21(24)29-18/h1-10H,(H,26,27)
InChIK	GPZCFDMVIYKQOP-UHFFFAOYSA-N
TotalMolweight	422.847
Molweight	422.847
MonoisotopicMass	422.012805
CLogP	4.5362
CLogS	-6.344
H Acceptors	6
H Donors	1
TotalSurfaceArea	291
Relative PSA	0.30454
PolarSurfaceArea	110.63
Druglikeness	4.2833
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55172
Fragments	1
Non HAtoms	29
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	2
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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