2-[(4Z)-4-[(2-chlorophenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]-4-sulfobenzoic acid

Formula:C23H15N2O6ClS Mutagenic:none Tumorigenic:high Reproductive Effective:none 2-[(4Z)-4-[(2-chlorophenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]-4-sulfobenzoic acid is a drug-like molecule.

MolName	2-[(4Z)-4-[(2-chlorophenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]-4-sulfobenzoic acid
MolecularFormula	C23H15N2O6ClS
Smiles	OC(c(ccc(S(O)(=O)=O)c1)c1N(C1=O)C(c2ccccc2)=N/C1=C\c(cccc1)c1Cl)=O
InChI	InChI=1S/C23H15ClN2O6S/c24-18-9-5-4-8-15(18)12-19-22(27)26(21(25-19)14-6-2-1-3-7-14)20-13-16(33(30,31)32)10-11-17(20)23(28)29/h1-13H,(H,28,29)(H,30,31,32)
InChIK	POQQILIJMMTKCQ-UHFFFAOYSA-N
TotalMolweight	482.899
Molweight	482.899
MonoisotopicMass	482.033935
CLogP	1.9992
CLogS	-4.621
H Acceptors	8
H Donors	2
TotalSurfaceArea	329.46
Relative PSA	0.29114
PolarSurfaceArea	132.72
Druglikeness	1.6338
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.39394
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	3
Amides	1
BasicNitrogens	1
AcidicOxygens	2
StereoCon

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