N-[(Z)-[1-[2-(2-prop-2-enylphenoxy)ethyl]indol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine

Formula:C27H24N4OS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[1-[2-(2-prop-2-enylphenoxy)ethyl]indol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine is not a drug-like molecule.

MolName	N-[(Z)-[1-[2-(2-prop-2-enylphenoxy)ethyl]indol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine
MolecularFormula	C27H24N4OS
Smiles	C=CCc(cccc1)c1OCCn1c(cccc2)c2c(/C=N\Nc2nc(cccc3)c3s2)c1
InChI	InChI=1S/C27H24N4OS/c1-2-9-20-10-3-7-14-25(20)32-17-16-31-19-21(22-11-4-6-13-24(22)31)18-28-30-27-29-23-12-5-8-15-26(23)33-27/h2-8,10-15,18-19H,1,9,16-17H2,(H,29,30)
InChIK	OUCYXIGZPJLTHG-UHFFFAOYSA-N
TotalMolweight	452.581
Molweight	452.581
MonoisotopicMass	452.167081
CLogP	8.1186
CLogS	-5.971
H Acceptors	5
H Donors	1
TotalSurfaceArea	357.92
Relative PSA	0.19884
PolarSurfaceArea	79.68
Druglikeness	1.8701
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.57576
Fragments	1
Non HAtoms	33
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	24
Sp3Atoms	4
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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1 - N-[(Z)-[1-[2-(2-prop-2-enylphenoxy)ethyl]indol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine | 2 - N-[(Z)-[1-[2-(2-prop-2-enylphenoxy)ethyl]indol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine

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