2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-[1-[(4-chlorophenyl)methyl]indol-3-yl]methylideneamino]acetamide

Formula:C27H21N8O2Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-[1-[(4-chlorophenyl)methyl]indol-3-yl]methylideneamino]acetamide is not a drug-like molecule.

MolName	2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-[1-[(4-chlorophenyl)methyl]indol-3-yl]methylideneamino]acetamide
MolecularFormula	C27H21N8O2Cl
Smiles	Nc1nonc1-c1nc(cccc2)c2n1CC(N/N=C/c1cn(Cc(cc2)ccc2Cl)c2c1cccc2)=O
InChI	InChI=1S/C27H21ClN8O2/c28-19-11-9-17(10-12-19)14-35-15-18(20-5-1-3-7-22(20)35)13-30-32-24(37)16-36-23-8-4-2-6-21(23)31-27(36)25-26(29)34-38-33-25/h1-13,15H,14,16H2,(H2,29,34)(H,32,37)
InChIK	YOHVOFNGXBTIHN-UHFFFAOYSA-N
TotalMolweight	524.971
Molweight	524.971
MonoisotopicMass	524.147599
CLogP	4.4837
CLogS	-5.457
H Acceptors	10
H Donors	2
TotalSurfaceArea	391.54
Relative PSA	0.28615
PolarSurfaceArea	129.15
Druglikeness	6.8598
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	38
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	6
Small Rings	6
Aromatic Rings	6
Aromatic Atoms	29
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	5
BasicNitrogens	1
StereoCon

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1 - 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-[1-[(4-chlorophenyl)methyl]indol-3-yl]methylideneamino]acetamide | 2 - 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-[1-[(4-chlorophenyl)methyl]indol-3-yl]methylideneamino]acetamide

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