3-[5-[(Z)-[[2-(3-bromophenoxy)acetyl]hydrazinylidene]methyl]furan-2-yl]-4-chlorobenzoate

Formula:C20H13N2O5BrCl Mutagenic:high Tumorigenic:high Reproductive Effective:low 3-[5-[(Z)-[[2-(3-bromophenoxy)acetyl]hydrazinylidene]methyl]furan-2-yl]-4-chlorobenzoate is a drug-like molecule.

MolName	3-[5-[(Z)-[[2-(3-bromophenoxy)acetyl]hydrazinylidene]methyl]furan-2-yl]-4-chlorobenzoate
MolecularFormula	C20H13N2O5BrCl
Smiles	[O-]C(c(cc1)cc(-c2ccc(/C=N\NC(COc3cccc(Br)c3)=O)o2)c1Cl)=O
InChI	InChI=1S/C20H14BrClN2O5/c21-13-2-1-3-14(9-13)28-11-19(25)24-23-10-15-5-7-18(29-15)16-8-12(20(26)27)4-6-17(16)22/h1-10H,11H2,(H,24,25)(H,26,27)/p-1
InChIK	BIILIZKIZQXRAT-UHFFFAOYSA-M
TotalMolweight	476.689
Molweight	476.689
MonoisotopicMass	474.969636
CLogP	2.4557
CLogS	-6.544
H Acceptors	7
H Donors	1
TotalSurfaceArea	319.53
Relative PSA	0.27365
PolarSurfaceArea	103.96
Druglikeness	4.7109
Mutagenic	high
Tumorigenic	high
Reproductive Effective	low
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.62069
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
AcidicOxygens	1
StereoCon

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