(E)-3-[4-[[(4Z)-4-(furan-2-ylmethylidene)-5-oxo-2-phenylimidazol-1-yl]sulfamoyl]phenyl]prop-2-enoic acid

Formula:C23H17N3O6S Mutagenic:high Tumorigenic:none Reproductive Effective:none (E)-3-[4-[[(4Z)-4-(furan-2-ylmethylidene)-5-oxo-2-phenylimidazol-1-yl]sulfamoyl]phenyl]prop-2-enoic acid is a drug-like molecule.

MolName(E)-3-[4-[[(4Z)-4-(furan-2-ylmethylidene)-5-oxo-2-phenylimidazol-1-yl]sulfamoyl]phenyl]prop-2-enoic acid
MolecularFormulaC23H17N3O6S
SmilesOC(/C=C/c(cc1)ccc1S(NN(C1=O)C(c2ccccc2)=N/C1=C\c1ccco1)(=O)=O)=O
InChIInChI=1S/C23H17N3O6S/c27-21(28)13-10-16-8-11-19(12-9-16)33(30,31)25-26-22(17-5-2-1-3-6-17)24-20(23(26)29)15-18-7-4-14-32-18/h1-15,25H,(H,27,28)
InChIKZPCKYZVGSXXRDJ-UHFFFAOYSA-N
TotalMolweight463.469
Molweight463.469
MonoisotopicMass463.083807
CLogP0.7948
CLogS-3.227
H Acceptors9
H Donors2
TotalSurfaceArea335.34
Relative PSA0.32322
PolarSurfaceArea137.66
Druglikeness6.215
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.51515
Fragments1
Non HAtoms33
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond6
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms2
Symmetricatoms5
BasicNitrogens1
AcidicOxygens1
StereoCon

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