1-(furan-2-ylmethyl)-3-(6H-indolo[3,2-b]quinoxalin-9-yl)thiourea

Formula:C20H15N5OS Mutagenic:high Tumorigenic:none Reproductive Effective:none 1-(furan-2-ylmethyl)-3-(6H-indolo[3,2-b]quinoxalin-9-yl)thiourea is a drug-like molecule.

MolName	1-(furan-2-ylmethyl)-3-(6H-indolo[3,2-b]quinoxalin-9-yl)thiourea
MolecularFormula	C20H15N5OS
Smiles	S=C(NCc1ccco1)Nc(cc1)cc2c1[nH]c1nc3ccccc3nc12
InChI	InChI=1S/C20H15N5OS/c27-20(21-11-13-4-3-9-26-13)22-12-7-8-15-14(10-12)18-19(24-15)25-17-6-2-1-5-16(17)23-18/h1-10H,11H2,(H,24,25)(H2,21,22,27)
InChIK	PATFVARJFZMSOF-UHFFFAOYSA-N
TotalMolweight	373.439
Molweight	373.439
MonoisotopicMass	373.09973
CLogP	3.2951
CLogS	-5.798
H Acceptors	6
H Donors	3
TotalSurfaceArea	282.99
Relative PSA	0.35676
PolarSurfaceArea	110.86
Druglikeness	0.0145
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.59259
Fragments	1
Non HAtoms	27
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	22
Sp3Atoms	2
Aromatic Nitrogens	3
StereoCon

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