N-[[4-(5H-[1,2,4]triazino[5,6-b]indol-3-ylhydrazinylidene)cyclohexylidene]amino]-5H-[1,2,4]triazino[5,6-b]indol-3-amine

Formula:C24H20N12 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[[4-(5H-[1,2,4]triazino[5,6-b]indol-3-ylhydrazinylidene)cyclohexylidene]amino]-5H-[1,2,4]triazino[5,6-b]indol-3-amine is not a drug-like molecule.

MolNameN-[[4-(5H-[1,2,4]triazino[5,6-b]indol-3-ylhydrazinylidene)cyclohexylidene]amino]-5H-[1,2,4]triazino[5,6-b]indol-3-amine
MolecularFormulaC24H20N12
SmilesC(C/C(/CC1)=N/Nc2nc([nH]c3c4cccc3)c4nn2)/C1=N\Nc1nnc(c(cccc2)c2[nH]2)c2n1
InChIInChI=1S/C24H20N12/c1-3-7-17-15(5-1)19-21(25-17)27-23(35-31-19)33-29-13-9-11-14(12-10-13)30-34-24-28-22-20(32-36-24)16-6-2-4-8-18(16)26-22/h1-8H,9-12H2,(H2,25,27,33,35)(H2,26,28,34,36)
InChIKLZWGGNYESUCFQT-UHFFFAOYSA-N
TotalMolweight476.507
Molweight476.507
MonoisotopicMass476.193388
CLogP6.6094
CLogS-7.036
H Acceptors12
H Donors4
TotalSurfaceArea353.52
Relative PSA0.39528
PolarSurfaceArea157.7
Druglikeness0.5075
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.61111
Fragments1
Non HAtoms36
NonCHAtoms12
Electronegative Atoms12
Rotatable Bond4
Rings Closures7
Small Rings7
Aromatic Rings6
Aromatic Atoms26
Sp3Atoms4
Symmetricatoms19
Aromatic Nitrogens8
StereoCon

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