4-[(2Z)-2-[[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]methylidene]hydrazinyl]benzoic acid

Formula:C22H17N4O2Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(2Z)-2-[[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]methylidene]hydrazinyl]benzoic acid is not a drug-like molecule.

MolName	4-[(2Z)-2-[[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]methylidene]hydrazinyl]benzoic acid
MolecularFormula	C22H17N4O2Cl
Smiles	OC(c(cc1)ccc1N/N=C\c1nc(cccc2)c2n1Cc(cc1)ccc1Cl)=O
InChI	InChI=1S/C22H17ClN4O2/c23-17-9-5-15(6-10-17)14-27-20-4-2-1-3-19(20)25-21(27)13-24-26-18-11-7-16(8-12-18)22(28)29/h1-13,26H,14H2,(H,28,29)
InChIK	ODOKEKPNQQNHCP-UHFFFAOYSA-N
TotalMolweight	404.856
Molweight	404.856
MonoisotopicMass	404.104003
CLogP	5.741
CLogS	-3.846
H Acceptors	6
H Donors	2
TotalSurfaceArea	304.84
Relative PSA	0.21962
PolarSurfaceArea	79.51
Druglikeness	3.9848
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	2
BasicNitrogens	1
AcidicOxygens	1
StereoCon

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1 - 4-[(2Z)-2-[[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]methylidene]hydrazinyl]benzoic acid | 2 - 4-[(2Z)-2-[[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]methylidene]hydrazinyl]benzoic acid

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