disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane

C185H214N14Na2O18P2S6+2 — CID 157128624

About disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane

disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane (PubChem CID 157128624) has the molecular formula C185H214N14Na2O18P2S6+2 and a molecular weight of 3222.16 g/mol. Its IUPAC name is disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane.

Molecular Properties

• Compound Name: disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane
• PubChem CID: 157128624
• Molecular Formula: C185H214N14Na2O18P2S6+2
• Molecular Weight: 3222.16 g/mol
• Exact Mass: 3219.38
• IUPAC Name: disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane
• SMILES: C.C.CCCCCCOC(C)c1c(C)c2cc3nc(c4c5[nH]c(cc6nc(cc1[nH]2)C(C)=C6CC)c(C)c5C(=O)C4)C(CCC(=O)Nc1ccc(SC2=C(C=CC4=[N+](CCCCS(=O)(=O)[O-])c5ccc6ccccc6c5C4(C)C)CCCC2=CC=C2N(CCCCS(=O)(=O)[O-])c4ccc5ccccc5c4C2(C)C)cc1)C3C.CCCCCCOC(C)c1c(C)c2n3c1=CC1=[N+]4C(=Cc5c(C)c6c7n5C34[N+]3=C(C=2)C(C)C(CCC(=O)Nc2ccc(SC4=C(C=CC5=[N+](CCCCS(=O)(=O)[O-])c8ccc9ccccc9c8C5(C)C)CCCC4=CC=C4N(CCCCS(=O)(=O)[O-])c5ccc8ccccc8c5C4(C)C)cc2)C3=C7CC6=O)C(CC)=C1C.PP.[Na+].[Na+]
• InChI: InChI=1S/C92H99N7O9S3.C91H103N7O9S3.2CH4.2Na.H4P2/c1-12-14-15-22-48-108-59(7)83-57(5)75-52-74-56(4)67(87-70-51-79(100)84-58(6)76-53-77-66(13-2)55(3)73-54-78(83)97(75)92(96(73)77,98(74)87)99(76)88(70)84)40-45-82(101)93-64-36-38-65(39-37-64)109-89-62(34-43-80-90(8,9)85-68-30-18-16-26-60(68)32-41-71(85)94(80)46-20-23-49-110(102,103)104)28-25-29-63(89)35-44-81-91(10,11)86-69-31-19-17-27-61(69)33-42-72(86)95(81)47-21-24-50-111(105,106)107;1-12-14-15-22-48-107-59(7)83-57(5)73-52-72-56(4)67(87(95-72)70-51-79(99)84-58(6)74(96-88(70)84)53-75-66(13-2)55(3)71(93-75)54-76(83)94-73)40-45-82(100)92-64-36-38-65(39-37-64)108-89-62(34-43-80-90(8,9)85-68-30-18-16-26-60(68)32-41-77(85)97(80)46-20-23-49-109(101,102)103)28-25-29-63(89)35-44-81-91(10,11)86-69-31-19-17-27-61(69)33-42-78(86)98(81)47-21-24-50-110(104,105)106;;;;;1-2/h16-19,26-27,30-39,41-44,52-54,56,59,67H,12-15,20-25,28-29,40,45-51H2,1-11H3;16-19,26-27,30-39,41-44,52-54,56,59,67H,12-15,20-25,28-29,40,45-51H2,1-11H3,(H4-,92,93,94,95,96,99,100,101,102,103,104,105,106);2*1H4;;;1-2H2/q;;;;2*+1
• InChIKey: YXBXZXHTTXEPNN-UHFFFAOYSA-N
• XLogP: 33.63
• TPSA: 425.34 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 26
• Rotatable Bonds: 54
• Heavy Atoms: 227
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3222.16
LogP ≤ 5	33.63
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane?

The IUPAC name of disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane (CID 157128624) is disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane.

What is the SMILES notation for disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane?

The canonical SMILES for disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane is C.C.CCCCCCOC(C)c1c(C)c2cc3nc(c4c5[nH]c(cc6nc(cc1[nH]2)C(C)=C6CC)c(C)c5C(=O)C4)C(CCC(=O)Nc1ccc(SC2=C(C=CC4=[N+](CCCCS(=O)(=O)[O-])c5ccc6ccccc6c5C4(C)C)CCCC2=CC=C2N(CCCCS(=O)(=O)[O-])c4ccc5ccccc5c4C2(C)C)cc1)C3C.CCCCCCOC(C)c1c(C)c2n3c1=CC1=[N+]4C(=Cc5c(C)c6c7n5C34[N+]3=C(C=2)C(C)C(CCC(=O)Nc2ccc(SC4=C(C=CC5=[N+](CCCCS(=O)(=O)[O-])c8ccc9ccccc9c8C5(C)C)CCCC4=CC=C4N(CCCCS(=O)(=O)[O-])c5ccc8ccccc8c5C4(C)C)cc2)C3=C7CC6=O)C(CC)=C1C.PP.[Na+].[Na+].

What is the InChIKey of disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane?

The InChIKey is YXBXZXHTTXEPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C92H99N7O9S3.C91H103N7O9S3.2CH4.2Na.H4P2/c1-12-14-15-22-48-108-59(7)83-57(5)75-52-74-56(4)67(87-70-51-79(100)84-58(6)76-53-77-66(13-2)55(3)73-54-78(83)97(75)92(96(73)77,98(74)87)99(76)88(70)84)40-45-82(101)93-64-36-38-65(39-37-64)109-89-62(34-43-80-90(8,9)85-68-30-18-16-26-60(68)32-41-71(85)94(80)46-20-23-49-110(102,103)104)28-25-29-63(89)35-44-81-91(10,11)86-69-31-19-17-27-61(69)33-42-72(86)95(81)47-21-24-50-111(105,106)107;1-12-14-15-22-48-107-59(7)83-57(5)73-52-72-56(4)67(87(95-72)70-51-79(99)84-58(6)74(96-88(70)84)53-75-66(13-2)55(3)71(93-75)54-76(83)94-73)40-45-82(100)92-64-36-38-65(39-37-64)108-89-62(34-43-80-90(8,9)85-68-30-18-16-26-60(68)32-41-77(85)97(80)46-20-23-49-109(101,102)103)28-25-29-63(89)35-44-81-91(10,11)86-69-31-19-17-27-61(69)33-42-78(86)98(81)47-21-24-50-110(104,105)106;;;;;1-2/h16-19,26-27,30-39,41-44,52-54,56,59,67H,12-15,20-25,28-29,40,45-51H2,1-11H3;16-19,26-27,30-39,41-44,52-54,56,59,67H,12-15,20-25,28-29,40,45-51H2,1-11H3,(H4-,92,93,94,95,96,99,100,101,102,103,104,105,106);2*1H4;;;1-2H2/q;;;;2*+1;.

What are the key properties of disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane?

disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane has a molecular weight of 3222.16 g/mol, XLogP of 33.63, 54 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for disodium;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[12-ethyl-17-(1-hexoxyethyl)-8,13,18,22-tetramethyl-6-oxo-2,27-diaza-25,26-diazonianonacyclo[12.11.1.11,16.02,9.03,7.04,24.011,26.021,25.019,27]heptacosa-3(7),4(24),8,10,12,14(26),15,17,19,21(25)-decaen-23-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;4-[2-[2-[3-[2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]-2-[4-[3-[11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoylamino]phenyl]sulfanylcyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate;methane;phosphanylphosphane is sourced from PubChem (CID 157128624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).