2-N-[(Z)-(4-fluorophenyl)methylideneamino]-6-morpholin-4-yl-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine

Formula:C26H24N7OF Mutagenic:high Tumorigenic:high Reproductive Effective:none 2-N-[(Z)-(4-fluorophenyl)methylideneamino]-6-morpholin-4-yl-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine is not a drug-like molecule.

MolName2-N-[(Z)-(4-fluorophenyl)methylideneamino]-6-morpholin-4-yl-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
MolecularFormulaC26H24N7OF
SmilesFc1ccc(/C=N\Nc2nc(N3CCOCC3)nc(N(c3ccccc3)c3ccccc3)n2)cc1
InChIInChI=1S/C26H24FN7O/c27-21-13-11-20(12-14-21)19-28-32-24-29-25(33-15-17-35-18-16-33)31-26(30-24)34(22-7-3-1-4-8-22)23-9-5-2-6-10-23/h1-14,19H,15-18H2,(H,29,30,31,32)
InChIKONMSBEORQAKGAW-UHFFFAOYSA-N
TotalMolweight469.523
Molweight469.523
MonoisotopicMass469.202636
CLogP6.6267
CLogS-7.928
H Acceptors8
H Donors1
TotalSurfaceArea363.53
Relative PSA0.20075
PolarSurfaceArea78.77
Druglikeness1.9585
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritanthigh
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.45714
Fragments1
Non HAtoms35
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond7
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms5
Symmetricatoms12
Aromatic Nitrogens3
BasicNitrogens3
StereoCon

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