(Z)-1-[2-[2-(4-cyclohexylphenoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Formula:C23H26N4O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-[2-[2-(4-cyclohexylphenoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName(Z)-1-[2-[2-(4-cyclohexylphenoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormulaC23H26N4O2
SmilesC(COc1c(/C=N\n2cnnc2)cccc1)Oc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C23H26N4O2/c1-2-6-19(7-3-1)20-10-12-22(13-11-20)28-14-15-29-23-9-5-4-8-21(23)16-26-27-17-24-25-18-27/h4-5,8-13,16-19H,1-3,6-7,14-15H2
InChIKIGCASBSWDUGEDN-UHFFFAOYSA-N
TotalMolweight390.485
Molweight390.485
MonoisotopicMass390.205576
CLogP4.7201
CLogS-7.345
H Acceptors6
TotalSurfaceArea319.58
Relative PSA0.18875
PolarSurfaceArea61.53
Druglikeness-8.6548
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.65517
Fragments1
Non HAtoms29
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond8
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms10
Symmetricatoms6
Aromatic Nitrogens3
StereoCon

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