N'-[(3E)-4-(1,3-benzodioxol-5-yl)buta-1,3-dien-2-yl]-3-fluorobenzohydrazide

Formula:C18H15N2O3F Mutagenic:none Tumorigenic:none Reproductive Effective:high N'-[(3E)-4-(1,3-benzodioxol-5-yl)buta-1,3-dien-2-yl]-3-fluorobenzohydrazide is a drug-like molecule.

MolName	N'-[(3E)-4-(1,3-benzodioxol-5-yl)buta-1,3-dien-2-yl]-3-fluorobenzohydrazide
MolecularFormula	C18H15N2O3F
Smiles	C=C(/C=C/c(cc1)cc2c1OCO2)NNC(c1cccc(F)c1)=O
InChI	InChI=1S/C18H15FN2O3/c1-12(20-21-18(22)14-3-2-4-15(19)10-14)5-6-13-7-8-16-17(9-13)24-11-23-16/h2-10,20H,1,11H2,(H,21,22)
InChIK	HXSDKBHDEHSEQI-UHFFFAOYSA-N
TotalMolweight	326.326
Molweight	326.326
MonoisotopicMass	326.106671
CLogP	3.5375
CLogS	-5.37
H Acceptors	5
H Donors	2
TotalSurfaceArea	249.55
Relative PSA	0.22424
PolarSurfaceArea	59.59
Druglikeness	-2.2251
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
StereoCon

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