N'-(benzenesulfonyl)-2,2,2-trichloro-N-(4-fluorophenyl)ethanimidamide

Formula:C14H10N2O2Cl3FS Mutagenic:high Tumorigenic:low Reproductive Effective:high N'-(benzenesulfonyl)-2,2,2-trichloro-N-(4-fluorophenyl)ethanimidamide is a drug-like molecule.

MolNameN'-(benzenesulfonyl)-2,2,2-trichloro-N-(4-fluorophenyl)ethanimidamide
MolecularFormulaC14H10N2O2Cl3FS
SmilesO=S(c1ccccc1)(/N=C(/C(Cl)(Cl)Cl)\Nc(cc1)ccc1F)=O
InChIInChI=1S/C14H10Cl3FN2O2S/c15-14(16,17)13(19-11-8-6-10(18)7-9-11)20-23(21,22)12-4-2-1-3-5-12/h1-9H,(H,19,20)
InChIKMIEXXFLHCCMOBH-UHFFFAOYSA-N
TotalMolweight395.668
Molweight395.668
MonoisotopicMass393.951257
CLogP4.1112
CLogS-4.565
H Acceptors4
H Donors1
TotalSurfaceArea259.05
Relative PSA0.199
PolarSurfaceArea66.91
Druglikeness-7.3608
Mutagenichigh
Tumorigeniclow
Reproductive Effectivehigh
Irritanthigh
Nasty Functions
Shape Index0.56522
Fragments1
Non HAtoms23
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms7
BasicNitrogens1
StereoCon

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