(E)-3-(2-chlorophenyl)-N-[2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]ethyl]prop-2-enamide

Formula:C20H18N2O2Cl2 Mutagenic:none Tumorigenic:high Reproductive Effective:none (E)-3-(2-chlorophenyl)-N-[2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]ethyl]prop-2-enamide is a drug-like molecule.

MolName(E)-3-(2-chlorophenyl)-N-[2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]ethyl]prop-2-enamide
MolecularFormulaC20H18N2O2Cl2
SmilesO=C(/C=C/c(cccc1)c1Cl)NCCNC(/C=C/c(cccc1)c1Cl)=O
InChIInChI=1S/C20H18Cl2N2O2/c21-17-7-3-1-5-15(17)9-11-19(25)23-13-14-24-20(26)12-10-16-6-2-4-8-18(16)22/h1-12H,13-14H2,(H,23,25)(H,24,26)
InChIKHTYQLSLTBRRVCX-UHFFFAOYSA-N
TotalMolweight389.281
Molweight389.281
MonoisotopicMass388.074532
CLogP3.9026
CLogS-5.07
H Acceptors4
H Donors2
TotalSurfaceArea302.8
Relative PSA0.16182
PolarSurfaceArea58.2
Druglikeness1.0858
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.69231
Fragments1
Non HAtoms26
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond7
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms13
Amides2
StereoCon

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