[4-[(Z)-[(2,4-dihydroxybenzoyl)hydrazinylidene]methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate

Formula:C23H15N2O5ClS Mutagenic:high Tumorigenic:none Reproductive Effective:none [4-[(Z)-[(2,4-dihydroxybenzoyl)hydrazinylidene]methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate is not a drug-like molecule.

MolName	[4-[(Z)-[(2,4-dihydroxybenzoyl)hydrazinylidene]methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate
MolecularFormula	C23H15N2O5ClS
Smiles	Oc(cc1)cc(O)c1C(N/N=C\c(cc1)ccc1OC(c(sc1c2cccc1)c2Cl)=O)=O
InChI	InChI=1S/C23H15ClN2O5S/c24-20-17-3-1-2-4-19(17)32-21(20)23(30)31-15-8-5-13(6-9-15)12-25-26-22(29)16-10-7-14(27)11-18(16)28/h1-12,27-28H,(H,26,29)
InChIK	SHHGJSNMBQSBHZ-UHFFFAOYSA-N
TotalMolweight	466.9
Molweight	466.9
MonoisotopicMass	466.03902
CLogP	5.4679
CLogS	-6.684
H Acceptors	7
H Donors	3
TotalSurfaceArea	333.16
Relative PSA	0.31699
PolarSurfaceArea	136.46
Druglikeness	5.3852
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; 3-halo-enone
Shape Index	0.625
Fragments	1
Non HAtoms	32
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	3
Symmetricatoms	2
StereoCon

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