1-[(3Z)-3-(phenylhydrazinylidene)furo[3,2-b]quinoxalin-2-yl]ethane-1,2-diol

Formula:C18H16N4O3 Mutagenic:high Tumorigenic:high Reproductive Effective:none 1-[(3Z)-3-(phenylhydrazinylidene)furo[3,2-b]quinoxalin-2-yl]ethane-1,2-diol is a drug-like molecule.

MolName	1-[(3Z)-3-(phenylhydrazinylidene)furo[3,2-b]quinoxalin-2-yl]ethane-1,2-diol
MolecularFormula	C18H16N4O3
Smiles	OCC(C1Oc2nc3ccccc3nc2/C1=N/Nc1ccccc1)O
InChI	InChI=1S/C18H16N4O3/c23-10-14(24)17-15(22-21-11-6-2-1-3-7-11)16-18(25-17)20-13-9-5-4-8-12(13)19-16/h1-9,14,17,21,23-24H,10H2
InChIK	OJWULAGRWCCWTE-UHFFFAOYSA-N
TotalMolweight	336.35
Molweight	336.35
MonoisotopicMass	336.122241
CLogP	3.2562
CLogS	-3.47
H Acceptors	7
H Donors	3
TotalSurfaceArea	247.53
Relative PSA	0.32768
PolarSurfaceArea	99.86
Druglikeness	1.3723
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	2
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	6
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon	unknown chirality

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