5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid

C102H68Cl4N58O17S4 — CID 136623511

About 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid

5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid (PubChem CID 136623511) has the molecular formula C102H68Cl4N58O17S4 and a molecular weight of 2648.13 g/mol. Its IUPAC name is 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid.

Molecular Properties

• Compound Name: 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid
• PubChem CID: 136623511
• Molecular Formula: C102H68Cl4N58O17S4
• Molecular Weight: 2648.13 g/mol
• Exact Mass: 2644.39
• IUPAC Name: 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid
• SMILES: [C-]#[N+]c1cnn(-c2c(Cl)cccc2Cl)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4c(Cl)cccc4Cl)c3N)n2)c1N.[C-]#[N+]c1cnn(-c2cc(C(=O)O)cc(C(=O)O)c2)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4cc(C(=O)O)cc(C(=O)O)c4)c3N)n2)c1N.[H]/N=C1/C(=NNc2c([N+]#[C-])c(C)nn2-c2nc3ccc(S(=O)(=O)O)cc3s2)C(C)=NC1c1nc(-n2nc(C)c(/N=N/c3c(C#N)c(C)nn3-c3nc4ccc(SOOO)cc4s3)c2N)nc(=O)[nH]1
• InChI: InChI=1S/C36H26N20O7S4.C35H23N19O9.C31H19Cl4N19O/c1-13-19(12-37)31(55(51-13)35-42-20-8-6-17(66-63-62-58)10-22(20)64-35)49-48-26-15(3)52-54(29(26)39)33-44-30(45-34(57)46-33)28-24(38)25(14(2)41-28)47-50-32-27(40-5)16(4)53-56(32)36-43-21-9-7-18(67(59,60)61)11-23(21)65-36;1-13-23(45-47-27-19(10-36)11-40-51(27)20-6-15(29(55)56)4-16(7-20)30(57)58)25(37)53(49-13)33-42-34(44-35(63)43-33)54-26(38)24(14(2)50-54)46-48-28-22(39-3)12-41-52(28)21-8-17(31(59)60)5-18(9-21)32(61)62;1-13-21(45-47-27-15(10-36)11-40-51(27)23-16(32)6-4-7-17(23)33)25(37)53(49-13)29-42-30(44-31(55)43-29)54-26(38)22(14(2)50-54)46-48-28-20(39-3)12-41-52(28)24-18(34)8-5-9-19(24)35/h6-11,28,38,50,58H,39H2,1-4H3,(H,59,60,61)(H,44,45,46,57);4-9,11-12H,37-38H2,1-2H3,(H,55,56)(H,57,58)(H,59,60)(H,61,62)(H,42,43,44,63);4-9,11-12H,37-38H2,1-2H3,(H,42,43,44,55)/b38-24-,47-25?,49-48+;2*47-45+,48-46+
• InChIKey: ZMNWUCVEBZJUGM-FCIXDHHXSA-N
• XLogP: 18.08
• TPSA: 1039.25 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 69
• Rotatable Bonds: 32
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2648.13
LogP ≤ 5	18.08
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	69

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid?

The IUPAC name of 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid (CID 136623511) is 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid.

What is the SMILES notation for 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid?

The canonical SMILES for 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid is [C-]#[N+]c1cnn(-c2c(Cl)cccc2Cl)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4c(Cl)cccc4Cl)c3N)n2)c1N.[C-]#[N+]c1cnn(-c2cc(C(=O)O)cc(C(=O)O)c2)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4cc(C(=O)O)cc(C(=O)O)c4)c3N)n2)c1N.[H]/N=C1/C(=NNc2c([N+]#[C-])c(C)nn2-c2nc3ccc(S(=O)(=O)O)cc3s2)C(C)=NC1c1nc(-n2nc(C)c(/N=N/c3c(C#N)c(C)nn3-c3nc4ccc(SOOO)cc4s3)c2N)nc(=O)[nH]1.

What is the InChIKey of 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid?

The InChIKey is ZMNWUCVEBZJUGM-FCIXDHHXSA-N. The full InChI is InChI=1S/C36H26N20O7S4.C35H23N19O9.C31H19Cl4N19O/c1-13-19(12-37)31(55(51-13)35-42-20-8-6-17(66-63-62-58)10-22(20)64-35)49-48-26-15(3)52-54(29(26)39)33-44-30(45-34(57)46-33)28-24(38)25(14(2)41-28)47-50-32-27(40-5)16(4)53-56(32)36-43-21-9-7-18(67(59,60)61)11-23(21)65-36;1-13-23(45-47-27-19(10-36)11-40-51(27)20-6-15(29(55)56)4-16(7-20)30(57)58)25(37)53(49-13)33-42-34(44-35(63)43-33)54-26(38)24(14(2)50-54)46-48-28-22(39-3)12-41-52(28)21-8-17(31(59)60)5-18(9-21)32(61)62;1-13-21(45-47-27-15(10-36)11-40-51(27)23-16(32)6-4-7-17(23)33)25(37)53(49-13)29-42-30(44-31(55)43-29)54-26(38)22(14(2)50-54)46-48-28-20(39-3)12-41-52(28)24-18(34)8-5-9-19(24)35/h6-11,28,38,50,58H,39H2,1-4H3,(H,59,60,61)(H,44,45,46,57);4-9,11-12H,37-38H2,1-2H3,(H,55,56)(H,57,58)(H,59,60)(H,61,62)(H,42,43,44,63);4-9,11-12H,37-38H2,1-2H3,(H,42,43,44,55)/b38-24-,47-25?,49-48+;2*47-45+,48-46+.

What are the key properties of 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid?

5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid has a molecular weight of 2648.13 g/mol, XLogP of 18.08, 32 rotatable bonds, 16 hydrogen bond donors, and 69 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,5-dicarboxyphenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]benzene-1,3-dicarboxylic acid;5-[[5-amino-1-[4-[5-amino-4-[[1-(2,6-dichlorophenyl)-4-isocyanopyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-1-(2,6-dichlorophenyl)pyrazole-4-carbonitrile;2-[5-[2-[2-[4-[5-amino-4-[[4-cyano-3-methyl-1-[6-(trioxidanylsulfanyl)-1,3-benzothiazol-2-yl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-oxo-1H-1,3,5-triazin-2-yl]-3-imino-5-methyl-2H-pyrrol-4-ylidene]hydrazinyl]-4-isocyano-3-methylpyrazol-1-yl]-1,3-benzothiazole-6-sulfonic acid is sourced from PubChem (CID 136623511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).