(Z)-1-[1-[2-(4-cyclohexylphenoxy)ethyl]indol-3-yl]-N-(1,2,4-triazol-4-yl)methanimine

Formula:C25H27N5O Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-[1-[2-(4-cyclohexylphenoxy)ethyl]indol-3-yl]-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-[1-[2-(4-cyclohexylphenoxy)ethyl]indol-3-yl]-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C25H27N5O
Smiles	C(COc1ccc(C2CCCCC2)cc1)n1c(cccc2)c2c(/C=N\n2cnnc2)c1
InChI	InChI=1S/C25H27N5O/c1-2-6-20(7-3-1)21-10-12-23(13-11-21)31-15-14-29-17-22(16-28-30-18-26-27-19-30)24-8-4-5-9-25(24)29/h4-5,8-13,16-20H,1-3,6-7,14-15H2
InChIK	LKBNQBKDIMBOFE-UHFFFAOYSA-N
TotalMolweight	413.523
Molweight	413.523
MonoisotopicMass	413.22156
CLogP	4.812
CLogS	-7.22
H Acceptors	6
TotalSurfaceArea	333.38
Relative PSA	0.17155
PolarSurfaceArea	57.23
Druglikeness	0.1404
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	9
Symmetricatoms	6
Aromatic Nitrogens	4
StereoCon

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1 - (Z)-1-[1-[2-(4-cyclohexylphenoxy)ethyl]indol-3-yl]-N-(1,2,4-triazol-4-yl)methanimine | 2 - (Z)-1-[1-[2-(4-cyclohexylphenoxy)ethyl]indol-3-yl]-N-(1,2,4-triazol-4-yl)methanimine

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