N-[(Z)-[2-(1H-benzimidazol-2-yl)-1-phenylethylidene]amino]-1,3-benzothiazol-2-amine

Formula:C22H17N5S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[2-(1H-benzimidazol-2-yl)-1-phenylethylidene]amino]-1,3-benzothiazol-2-amine is not a drug-like molecule.

MolNameN-[(Z)-[2-(1H-benzimidazol-2-yl)-1-phenylethylidene]amino]-1,3-benzothiazol-2-amine
MolecularFormulaC22H17N5S
SmilesC(/C(/c1ccccc1)=N/Nc1nc(cccc2)c2s1)c1nc(cccc2)c2[nH]1
InChIInChI=1S/C22H17N5S/c1-2-8-15(9-3-1)19(14-21-23-16-10-4-5-11-17(16)24-21)26-27-22-25-18-12-6-7-13-20(18)28-22/h1-13H,14H2,(H,23,24)(H,25,27)
InChIKLTCFPMNJKPDJNG-UHFFFAOYSA-N
TotalMolweight383.478
Molweight383.478
MonoisotopicMass383.120465
CLogP6.5122
CLogS-5.106
H Acceptors5
H Donors2
TotalSurfaceArea293.2
Relative PSA0.27033
PolarSurfaceArea94.2
Druglikeness2.4132
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms28
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond5
Rings Closures5
Small Rings5
Aromatic Rings5
Aromatic Atoms24
Sp3Atoms1
Symmetricatoms2
Aromatic Nitrogens3
BasicNitrogens2
StereoCon

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