4-(4-fluorophenyl)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-1,3-thiazol-2-amine

Formula:C18H14N3FS Mutagenic:none Tumorigenic:high Reproductive Effective:none 4-(4-fluorophenyl)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-1,3-thiazol-2-amine is not a drug-like molecule.

MolName4-(4-fluorophenyl)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-1,3-thiazol-2-amine
MolecularFormulaC18H14N3FS
SmilesFc(cc1)ccc1-c1csc(N/N=C\C=C\c2ccccc2)n1
InChIInChI=1S/C18H14FN3S/c19-16-10-8-15(9-11-16)17-13-23-18(21-17)22-20-12-4-7-14-5-2-1-3-6-14/h1-13H,(H,21,22)
InChIKHLGOXGBDTNWXIK-UHFFFAOYSA-N
TotalMolweight323.394
Molweight323.394
MonoisotopicMass323.089245
CLogP6.3355
CLogS-5.266
H Acceptors3
H Donors1
TotalSurfaceArea256.55
Relative PSA0.21165
PolarSurfaceArea65.52
Druglikeness2.6241
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.73913
Fragments1
Non HAtoms23
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Symmetricatoms4
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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