2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide

C146H229F2N23O47S7 — CID 172981630

About 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide

2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide (PubChem CID 172981630) has the molecular formula C146H229F2N23O47S7 and a molecular weight of 3319.02 g/mol. Its IUPAC name is 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide.

Molecular Properties

• Compound Name: 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide
• PubChem CID: 172981630
• Molecular Formula: C146H229F2N23O47S7
• Molecular Weight: 3319.02 g/mol
• Exact Mass: 3316.43
• IUPAC Name: 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide
• SMILES: CCC(=O)CCCOCCOCCOCCOCCOCCCC(=O)CSCCC[18F].CCC(=O)[C@@H]1CSCC(=O)N[C@@H](CCCCNC(=O)COCC(=O)NCCOCCOCCOCCOCCONC(=O)CO/N=C/c2ccc([18F])cc2)C(=O)N[C@H]2CSSC[C@H](NC(=O)[C@H](CC(=O)O)CC(=O)CNC(=O)[C@H](CCCN=C(N)N)CC2=O)C(=O)C[C@@H](Cc2ccccc2)C(=O)N1.CCCOCCOCCOCCCC(=O)COCC(N)=O.COCC(=O)NCCCC[C@@H]1NC(=O)CSC[C@@H](C(N)=O)NC(=O)[C@H](Cc2ccccc2)CC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)CC(=O)CNC(=O)[C@H](CCCN=C(N)N)CC(=O)[C@H](CS)NC1=O
• InChI: InChI=1S/C66H95FN12O21S3.C44H66N10O13S3.C22H41FO7S.C14H27NO6/c1-2-54(81)51-39-101-42-60(87)75-50(12-6-7-17-70-57(84)36-98-37-58(85)71-19-20-94-21-22-95-23-24-96-25-26-97-27-28-99-79-59(86)38-100-74-34-44-13-15-48(67)16-14-44)65(93)78-53-41-103-102-40-52(56(83)32-46(63(91)76-51)29-43-9-4-3-5-10-43)77-64(92)47(33-61(88)89)30-49(80)35-73-62(90)45(31-55(53)82)11-8-18-72-66(68)69;1-67-20-36(58)48-12-6-5-11-30-43(66)53-32(22-69)34(56)16-26(10-7-13-49-44(46)47)40(63)50-19-29(55)15-28(18-38(60)61)42(65)52-31(21-68)35(57)17-27(14-25-8-3-2-4-9-25)41(64)54-33(39(45)62)23-70-24-37(59)51-30;1-2-21(24)6-3-9-26-11-13-28-15-17-30-18-16-29-14-12-27-10-4-7-22(25)20-31-19-5-8-23;1-2-5-18-7-9-20-10-8-19-6-3-4-13(16)11-21-12-14(15)17/h3-5,9-10,13-16,34,45-47,50-53H,2,6-8,11-12,17-33,35-42H2,1H3,(H,70,84)(H,71,85)(H,73,90)(H,75,87)(H,76,91)(H,77,92)(H,78,93)(H,79,86)(H,88,89)(H4,68,69,72);2-4,8-9,26-28,30-33,68-69H,5-7,10-24H2,1H3,(H2,45,62)(H,48,58)(H,50,63)(H,51,59)(H,52,65)(H,53,66)(H,54,64)(H,60,61)(H4,46,47,49);2-20H2,1H3;2-12H2,1H3,(H2,15,17)/b74-34+;;;/t45-,46-,47+,50+,51+,52+,53+;26-,27-,28+,30+,31+,32+,33+;;/m11../s1/i67-1;;23-1
• InChIKey: FOFDNJPPSLSWFB-GOKDSLSSSA-N
• XLogP: 0.51
• TPSA: 1036.95 Ų
• H-Bond Donors: 24
• H-Bond Acceptors: 55
• Rotatable Bonds: 99
• Heavy Atoms: 225
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3319.02
LogP ≤ 5	0.51
H-Bond Donors ≤ 5	24
H-Bond Acceptors ≤ 10	55

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide?

The IUPAC name of 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide (CID 172981630) is 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide.

What is the SMILES notation for 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide?

The canonical SMILES for 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide is CCC(=O)CCCOCCOCCOCCOCCOCCCC(=O)CSCCC[18F].CCC(=O)[C@@H]1CSCC(=O)N[C@@H](CCCCNC(=O)COCC(=O)NCCOCCOCCOCCOCCONC(=O)CO/N=C/c2ccc([18F])cc2)C(=O)N[C@H]2CSSC[C@H](NC(=O)[C@H](CC(=O)O)CC(=O)CNC(=O)[C@H](CCCN=C(N)N)CC2=O)C(=O)C[C@@H](Cc2ccccc2)C(=O)N1.CCCOCCOCCOCCCC(=O)COCC(N)=O.COCC(=O)NCCCC[C@@H]1NC(=O)CSC[C@@H](C(N)=O)NC(=O)[C@H](Cc2ccccc2)CC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)CC(=O)CNC(=O)[C@H](CCCN=C(N)N)CC(=O)[C@H](CS)NC1=O.

What is the InChIKey of 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide?

The InChIKey is FOFDNJPPSLSWFB-GOKDSLSSSA-N. The full InChI is InChI=1S/C66H95FN12O21S3.C44H66N10O13S3.C22H41FO7S.C14H27NO6/c1-2-54(81)51-39-101-42-60(87)75-50(12-6-7-17-70-57(84)36-98-37-58(85)71-19-20-94-21-22-95-23-24-96-25-26-97-27-28-99-79-59(86)38-100-74-34-44-13-15-48(67)16-14-44)65(93)78-53-41-103-102-40-52(56(83)32-46(63(91)76-51)29-43-9-4-3-5-10-43)77-64(92)47(33-61(88)89)30-49(80)35-73-62(90)45(31-55(53)82)11-8-18-72-66(68)69;1-67-20-36(58)48-12-6-5-11-30-43(66)53-32(22-69)34(56)16-26(10-7-13-49-44(46)47)40(63)50-19-29(55)15-28(18-38(60)61)42(65)52-31(21-68)35(57)17-27(14-25-8-3-2-4-9-25)41(64)54-33(39(45)62)23-70-24-37(59)51-30;1-2-21(24)6-3-9-26-11-13-28-15-17-30-18-16-29-14-12-27-10-4-7-22(25)20-31-19-5-8-23;1-2-5-18-7-9-20-10-8-19-6-3-4-13(16)11-21-12-14(15)17/h3-5,9-10,13-16,34,45-47,50-53H,2,6-8,11-12,17-33,35-42H2,1H3,(H,70,84)(H,71,85)(H,73,90)(H,75,87)(H,76,91)(H,77,92)(H,78,93)(H,79,86)(H,88,89)(H4,68,69,72);2-4,8-9,26-28,30-33,68-69H,5-7,10-24H2,1H3,(H2,45,62)(H,48,58)(H,50,63)(H,51,59)(H,52,65)(H,53,66)(H,54,64)(H,60,61)(H4,46,47,49);2-20H2,1H3;2-12H2,1H3,(H2,15,17)/b74-34+;;;/t45-,46-,47+,50+,51+,52+,53+;26-,27-,28+,30+,31+,32+,33+;;/m11../s1/i67-1;;23-1;.

What are the key properties of 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide?

2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide has a molecular weight of 3319.02 g/mol, XLogP of 0.51, 99 rotatable bonds, 24 hydrogen bond donors, and 55 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(5S,8R,11R,17S,20R,23R,26R)-23-benzyl-26-carbamoyl-11-[3-(diaminomethylideneamino)propyl]-5-[4-[(2-methoxyacetyl)amino]butyl]-3,6,9,12,15,18,21,24-octaoxo-8,20-bis(sulfanylmethyl)-1-thia-4,7,13,19,25-pentazacycloheptacos-17-yl]acetic acid;2-[(1R,4S,10R,13R,16R,19S,25R)-13-benzyl-25-[3-(diaminomethylideneamino)propyl]-4-[4-[[2-[2-[2-[2-[2-[2-[2-[[2-[(E)-(4-fluorophenyl)methylideneamino]oxyacetyl]amino]oxyethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]butyl]-3,6,12,15,18,21,24,27-octaoxo-10-propanoyl-8,29,30-trithia-2,5,11,17,23-pentazabicyclo[14.11.4]hentriacontan-19-yl]acetic acid;6-[2-[2-[2-[2-[5-(3-(18F)fluoropropylsulfanyl)-4-oxopentoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-3-one;2-[2-oxo-5-[2-(2-propoxyethoxy)ethoxy]pentoxy]acetamide is sourced from PubChem (CID 172981630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).