(E)-N'-[2-(2,4-dichlorophenoxy)acetyl]-3-(4-fluorophenyl)prop-2-enehydrazide

Formula:C17H13N2O3Cl2F Mutagenic:high Tumorigenic:high Reproductive Effective:high (E)-N'-[2-(2,4-dichlorophenoxy)acetyl]-3-(4-fluorophenyl)prop-2-enehydrazide is a drug-like molecule.

MolName(E)-N'-[2-(2,4-dichlorophenoxy)acetyl]-3-(4-fluorophenyl)prop-2-enehydrazide
MolecularFormulaC17H13N2O3Cl2F
SmilesO=C(COc(ccc(Cl)c1)c1Cl)NNC(/C=C/c(cc1)ccc1F)=O
InChIInChI=1S/C17H13Cl2FN2O3/c18-12-4-7-15(14(19)9-12)25-10-17(24)22-21-16(23)8-3-11-1-5-13(20)6-2-11/h1-9H,10H2,(H,21,23)(H,22,24)
InChIKYDZKKKXHHILWQO-UHFFFAOYSA-N
TotalMolweight383.205
Molweight383.205
MonoisotopicMass382.028725
CLogP2.8345
CLogS-5.246
H Acceptors5
H Donors2
TotalSurfaceArea278.89
Relative PSA0.21155
PolarSurfaceArea67.43
Druglikeness-0.7355
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functions
Shape Index0.72
Fragments1
Non HAtoms25
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms2
StereoCon

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