(Z)-2-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]-3-(3-phenoxyphenyl)prop-2-enenitrile

Formula:C30H26N2OS Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-2-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]-3-(3-phenoxyphenyl)prop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-2-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]-3-(3-phenoxyphenyl)prop-2-enenitrile
MolecularFormula	C30H26N2OS
Smiles	N#C/C(/c1nc(-c2ccc(C3CCCCC3)cc2)cs1)=C/c1cc(Oc2ccccc2)ccc1
InChI	InChI=1S/C30H26N2OS/c31-20-26(18-22-8-7-13-28(19-22)33-27-11-5-2-6-12-27)30-32-29(21-34-30)25-16-14-24(15-17-25)23-9-3-1-4-10-23/h2,5-8,11-19,21,23H,1,3-4,9-10H2
InChIK	FOYUOBSNBCSVTA-UHFFFAOYSA-N
TotalMolweight	462.615
Molweight	462.615
MonoisotopicMass	462.176583
CLogP	7.4453
CLogS	-8.501
H Acceptors	3
TotalSurfaceArea	371.46
Relative PSA	0.14777
PolarSurfaceArea	74.15
Druglikeness	-6.6324
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	7
Symmetricatoms	6
Aromatic Nitrogens	1
StereoCon

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