2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid

C97H69N57O35S8 — CID 161161877

About 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid

2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid (PubChem CID 161161877) has the molecular formula C97H69N57O35S8 and a molecular weight of 2849.52 g/mol. Its IUPAC name is 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid.

Molecular Properties

• Compound Name: 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid
• PubChem CID: 161161877
• Molecular Formula: C97H69N57O35S8
• Molecular Weight: 2849.52 g/mol
• Exact Mass: 2847.31
• IUPAC Name: 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid
• SMILES: [C-]#[N+]c1cnn(-c2cc(SOOO)cc(S(=O)(=O)O)c2)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4cc(SOOO)cc(S(=O)(=O)O)c4)c3N)n2)c1N.[C-]#[N+]c1cnn(-c2cc(SOOO)ccc2S(=O)(=O)O)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4cc(S(=O)(=O)O)ccc4SOOO)c3N)n2)c1N.[C-]#[N+]c1cnn(-c2ccc(C(=O)O)c(C(=O)O)c2)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4ccc(C(=O)O)c(C(=O)O)c4)c3N)n2)c1N
• InChI: InChI=1S/C35H23N19O9.2C31H23N19O13S4/c1-13-23(45-47-27-15(10-36)11-40-51(27)16-4-6-18(29(55)56)20(8-16)31(59)60)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)17-5-7-19(30(57)58)21(9-17)32(61)62;1-13-23(41-43-27-15(10-32)11-36-47(27)16-4-18(64-62-60-52)8-20(6-16)66(54,55)56)25(33)49(45-13)29-38-30(40-31(51)39-29)50-26(34)24(14(2)46-50)42-44-28-22(35-3)12-37-48(28)17-5-19(65-63-61-53)9-21(7-17)67(57,58)59;1-13-23(41-43-27-15(10-32)11-36-47(27)19-9-17(66(54,55)56)5-6-21(19)65-63-61-53)25(33)49(45-13)29-38-30(40-31(51)39-29)50-26(34)24(14(2)46-50)42-44-28-18(35-3)12-37-48(28)20-8-16(64-62-60-52)4-7-22(20)67(57,58)59/h4-9,11-12H,37-38H2,1-2H3,(H,55,56)(H,57,58)(H,59,60)(H,61,62)(H,42,43,44,63);2*4-9,11-12,52-53H,33-34H2,1-2H3,(H,54,55,56)(H,57,58,59)(H,38,39,40,51)/b47-45+,48-46+;2*43-41+,44-42+
• InChIKey: UQAHCJKLPCIYBX-JHXWDVEMSA-N
• XLogP: 13.56
• TPSA: 1300.87 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 85
• Rotatable Bonds: 44
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2849.52
LogP ≤ 5	13.56
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	85

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid?

The IUPAC name of 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid (CID 161161877) is 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid.

What is the SMILES notation for 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid?

The canonical SMILES for 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid is [C-]#[N+]c1cnn(-c2cc(SOOO)cc(S(=O)(=O)O)c2)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4cc(SOOO)cc(S(=O)(=O)O)c4)c3N)n2)c1N.[C-]#[N+]c1cnn(-c2cc(SOOO)ccc2S(=O)(=O)O)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4cc(S(=O)(=O)O)ccc4SOOO)c3N)n2)c1N.[C-]#[N+]c1cnn(-c2ccc(C(=O)O)c(C(=O)O)c2)c1/N=N/c1c(C)nn(-c2nc(O)nc(-n3nc(C)c(/N=N/c4c(C#N)cnn4-c4ccc(C(=O)O)c(C(=O)O)c4)c3N)n2)c1N.

What is the InChIKey of 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid?

The InChIKey is UQAHCJKLPCIYBX-JHXWDVEMSA-N. The full InChI is InChI=1S/C35H23N19O9.2C31H23N19O13S4/c1-13-23(45-47-27-15(10-36)11-40-51(27)16-4-6-18(29(55)56)20(8-16)31(59)60)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)17-5-7-19(30(57)58)21(9-17)32(61)62;1-13-23(41-43-27-15(10-32)11-36-47(27)16-4-18(64-62-60-52)8-20(6-16)66(54,55)56)25(33)49(45-13)29-38-30(40-31(51)39-29)50-26(34)24(14(2)46-50)42-44-28-22(35-3)12-37-48(28)17-5-19(65-63-61-53)9-21(7-17)67(57,58)59;1-13-23(41-43-27-15(10-32)11-36-47(27)19-9-17(66(54,55)56)5-6-21(19)65-63-61-53)25(33)49(45-13)29-38-30(40-31(51)39-29)50-26(34)24(14(2)46-50)42-44-28-18(35-3)12-37-48(28)20-8-16(64-62-60-52)4-7-22(20)67(57,58)59/h4-9,11-12H,37-38H2,1-2H3,(H,55,56)(H,57,58)(H,59,60)(H,61,62)(H,42,43,44,63);2*4-9,11-12,52-53H,33-34H2,1-2H3,(H,54,55,56)(H,57,58,59)(H,38,39,40,51)/b47-45+,48-46+;2*43-41+,44-42+.

What are the key properties of 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid?

2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid has a molecular weight of 2849.52 g/mol, XLogP of 13.56, 44 rotatable bonds, 21 hydrogen bond donors, and 85 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-[[5-amino-1-[4-[5-amino-4-[[4-cyano-1-[5-sulfo-2-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-isocyanopyrazol-1-yl]-4-(trioxidanylsulfanyl)benzenesulfonic acid;4-[5-[[5-amino-1-[4-[5-amino-4-[[1-(3,4-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]phthalic acid;3-[5-[[5-amino-1-[4-[5-amino-4-[[4-isocyano-1-[3-sulfo-5-(trioxidanylsulfanyl)phenyl]pyrazol-5-yl]diazenyl]-3-methylpyrazol-1-yl]-6-hydroxy-1,3,5-triazin-2-yl]-3-methylpyrazol-4-yl]diazenyl]-4-cyanopyrazol-1-yl]-5-(trioxidanylsulfanyl)benzenesulfonic acid is sourced from PubChem (CID 161161877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).