2-amino-1-[(Z)-furan-2-ylmethylideneamino]-N-(2-phenylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Formula:C24H20N6O2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-amino-1-[(Z)-furan-2-ylmethylideneamino]-N-(2-phenylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide is a drug-like molecule.

MolName	2-amino-1-[(Z)-furan-2-ylmethylideneamino]-N-(2-phenylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
MolecularFormula	C24H20N6O2
Smiles	Nc1c(C(NCCc2ccccc2)=O)c2nc3ccccc3nc2n1/N=C\c1ccco1
InChI	InChI=1S/C24H20N6O2/c25-22-20(24(31)26-13-12-16-7-2-1-3-8-16)21-23(29-19-11-5-4-10-18(19)28-21)30(22)27-15-17-9-6-14-32-17/h1-11,14-15H,12-13,25H2,(H,26,31)
InChIK	KVHBAGASCUNSPQ-UHFFFAOYSA-N
TotalMolweight	424.463
Molweight	424.463
MonoisotopicMass	424.164774
CLogP	3.4906
CLogS	-8.154
H Acceptors	8
H Donors	2
TotalSurfaceArea	328.4
Relative PSA	0.28685
PolarSurfaceArea	111.33
Druglikeness	5.839
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	24
Sp3Atoms	3
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	3
StereoCon

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