[4-bromo-2-[(Z)-[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] furan-2-carboxylate

Formula:C21H15N3O5BrF Mutagenic:high Tumorigenic:none Reproductive Effective:none [4-bromo-2-[(Z)-[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] furan-2-carboxylate is a drug-like molecule.

MolName	[4-bromo-2-[(Z)-[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] furan-2-carboxylate
MolecularFormula	C21H15N3O5BrF
Smiles	O=C(CNC(c1cc(F)ccc1)=O)N/N=C\c(cc(cc1)Br)c1OC(c1ccco1)=O
InChI	InChI=1S/C21H15BrFN3O5/c22-15-6-7-17(31-21(29)18-5-2-8-30-18)14(9-15)11-25-26-19(27)12-24-20(28)13-3-1-4-16(23)10-13/h1-11H,12H2,(H,24,28)(H,26,27)
InChIK	XRMNNDBRLJTPMK-UHFFFAOYSA-N
TotalMolweight	488.268
Molweight	488.268
MonoisotopicMass	487.017911
CLogP	3.7305
CLogS	-5.788
H Acceptors	8
H Donors	2
TotalSurfaceArea	332.14
Relative PSA	0.29403
PolarSurfaceArea	110
Druglikeness	2.1854
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Amides	1
StereoCon

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