1-(6H-indolo[3,2-b]quinoxalin-9-yl)-3-naphthalen-2-ylurea

Formula:C25H17N5O Mutagenic:high Tumorigenic:high Reproductive Effective:none 1-(6H-indolo[3,2-b]quinoxalin-9-yl)-3-naphthalen-2-ylurea is not a drug-like molecule.

MolName1-(6H-indolo[3,2-b]quinoxalin-9-yl)-3-naphthalen-2-ylurea
MolecularFormulaC25H17N5O
SmilesO=C(Nc(cc1)cc2c1[nH]c1nc3ccccc3nc12)Nc1cc2ccccc2cc1
InChIInChI=1S/C25H17N5O/c31-25(26-17-10-9-15-5-1-2-6-16(15)13-17)27-18-11-12-20-19(14-18)23-24(29-20)30-22-8-4-3-7-21(22)28-23/h1-14H,(H,29,30)(H2,26,27,31)
InChIKJCEZQMOMDTXYOL-UHFFFAOYSA-N
TotalMolweight403.444
Molweight403.444
MonoisotopicMass403.14331
CLogP5.1947
CLogS-7.822
H Acceptors6
H Donors3
TotalSurfaceArea299.18
Relative PSA0.24029
PolarSurfaceArea82.7
Druglikeness0.029297
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.58065
Fragments1
Non HAtoms31
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond2
Rings Closures6
Small Rings6
Aromatic Rings6
Aromatic Atoms27
Amides2
Aromatic Nitrogens3
StereoCon

Request More Details | 1-(6H-indolo[3,2-b]quinoxalin-9-yl)-3-naphthalen-2-ylurea


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments