N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide)

C199H271N47O25S4 — CID 162075049

About N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide)

N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide) (PubChem CID 162075049) has the molecular formula C199H271N47O25S4 and a molecular weight of 3849.93 g/mol. Its IUPAC name is N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide).

Molecular Properties

• Compound Name: N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide)
• PubChem CID: 162075049
• Molecular Formula: C199H271N47O25S4
• Molecular Weight: 3849.93 g/mol
• Exact Mass: 3847.03
• IUPAC Name: N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide)
• SMILES: CCCN(CC(=O)NCCSC)C(=O)CN(CCc1c[nH]c2ccccc12)C(=O)CCC(=O)CN(CCCN=C(N)N)C(=O)CN(CCC1=CCc2ccccc21)C(=O)CNCCc1cnc[nH]1.CCCN(CC(=O)NCCSC)C(=O)CN(CCc1c[nH]c2ccccc12)C(=O)CCC(=O)CN(CCCN=C(N)N)C(=O)CN(CCC1=CCc2ccccc21)C(=O)CNCc1cccnc1.CCCN(CC(=O)NCCSC)C(=O)CN(CCc1c[nH]c2ccccc12)C(=O)CCC(=O)CN(CCCN=C(N)N)C(=O)CN(CCC1=CCc2ccccc21)C(=O)CNCc1cccnc1.CCCN(CC(=O)N[C@@H](CSC)C(N)=O)C(=O)CN(CCc1c[nH]c2ccccc12)C(=O)CCC(=O)CN(CCCN=C(N)N)C(=O)CN(CCC1=CCc2ccccc21)C(=O)CNCCc1cnc[nH]1
• InChI: InChI=1S/C50H69N13O7S.2C50H67N11O6S.C49H68N12O6S/c1-3-22-60(30-44(65)59-43(33-71-2)49(51)70)47(68)31-62(25-19-37-26-57-42-12-7-6-11-41(37)42)45(66)16-15-39(64)29-61(23-8-20-56-50(52)53)48(69)32-63(46(67)28-54-21-17-38-27-55-34-58-38)24-18-36-14-13-35-9-4-5-10-40(35)36;2*1-3-24-58(34-45(63)55-23-28-68-2)48(66)35-60(27-20-40-31-57-44-14-7-6-13-43(40)44)46(64)18-17-41(62)33-59(25-9-22-56-50(51)52)49(67)36-61(47(65)32-54-30-37-10-8-21-53-29-37)26-19-39-16-15-38-11-4-5-12-42(38)39;1-3-23-58(32-44(63)54-22-27-68-2)47(66)33-60(26-19-38-28-56-43-12-7-6-11-42(38)43)45(64)16-15-40(62)31-59(24-8-20-55-49(50)51)48(67)34-61(46(65)30-52-21-17-39-29-53-35-57-39)25-18-37-14-13-36-9-4-5-10-41(36)37/h4-7,9-12,14,26-27,34,43,54,57H,3,8,13,15-25,28-33H2,1-2H3,(H2,51,70)(H,55,58)(H,59,65)(H4,52,53,56);2*4-8,10-14,16,21,29,31,54,57H,3,9,15,17-20,22-28,30,32-36H2,1-2H3,(H,55,63)(H4,51,52,56);4-7,9-12,14,28-29,35,52,56H,3,8,13,15-27,30-34H2,1-2H3,(H,53,57)(H,54,63)(H4,50,51,55)/t43-;;;/m0.../s1
• InChIKey: ZBPDNVRBEIOBEI-NUPNYDKBSA-N
• XLogP: 10.16
• TPSA: 1004.75 Ų
• H-Bond Donors: 23
• H-Bond Acceptors: 41
• Rotatable Bonds: 123
• Heavy Atoms: 275
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3849.93
LogP ≤ 5	10.16
H-Bond Donors ≤ 5	23
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide)?

The IUPAC name of N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide) (CID 162075049) is N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide).

What is the SMILES notation for N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide)?

The canonical SMILES for N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide) is CCCN(CC(=O)NCCSC)C(=O)CN(CCc1c[nH]c2ccccc12)C(=O)CCC(=O)CN(CCCN=C(N)N)C(=O)CN(CCC1=CCc2ccccc21)C(=O)CNCCc1cnc[nH]1.CCCN(CC(=O)NCCSC)C(=O)CN(CCc1c[nH]c2ccccc12)C(=O)CCC(=O)CN(CCCN=C(N)N)C(=O)CN(CCC1=CCc2ccccc21)C(=O)CNCc1cccnc1.CCCN(CC(=O)NCCSC)C(=O)CN(CCc1c[nH]c2ccccc12)C(=O)CCC(=O)CN(CCCN=C(N)N)C(=O)CN(CCC1=CCc2ccccc21)C(=O)CNCc1cccnc1.CCCN(CC(=O)N[C@@H](CSC)C(N)=O)C(=O)CN(CCc1c[nH]c2ccccc12)C(=O)CCC(=O)CN(CCCN=C(N)N)C(=O)CN(CCC1=CCc2ccccc21)C(=O)CNCCc1cnc[nH]1.

What is the InChIKey of N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide)?

The InChIKey is ZBPDNVRBEIOBEI-NUPNYDKBSA-N. The full InChI is InChI=1S/C50H69N13O7S.2C50H67N11O6S.C49H68N12O6S/c1-3-22-60(30-44(65)59-43(33-71-2)49(51)70)47(68)31-62(25-19-37-26-57-42-12-7-6-11-41(37)42)45(66)16-15-39(64)29-61(23-8-20-56-50(52)53)48(69)32-63(46(67)28-54-21-17-38-27-55-34-58-38)24-18-36-14-13-35-9-4-5-10-40(35)36;2*1-3-24-58(34-45(63)55-23-28-68-2)48(66)35-60(27-20-40-31-57-44-14-7-6-13-43(40)44)46(64)18-17-41(62)33-59(25-9-22-56-50(51)52)49(67)36-61(47(65)32-54-30-37-10-8-21-53-29-37)26-19-39-16-15-38-11-4-5-12-42(38)39;1-3-23-58(32-44(63)54-22-27-68-2)47(66)33-60(26-19-38-28-56-43-12-7-6-11-42(38)43)45(64)16-15-40(62)31-59(24-8-20-55-49(50)51)48(67)34-61(46(65)30-52-21-17-39-29-53-35-57-39)25-18-37-14-13-36-9-4-5-10-41(36)37/h4-7,9-12,14,26-27,34,43,54,57H,3,8,13,15-25,28-33H2,1-2H3,(H2,51,70)(H,55,58)(H,59,65)(H4,52,53,56);2*4-8,10-14,16,21,29,31,54,57H,3,9,15,17-20,22-28,30,32-36H2,1-2H3,(H,55,63)(H4,51,52,56);4-7,9-12,14,28-29,35,52,56H,3,8,13,15-27,30-34H2,1-2H3,(H,53,57)(H,54,63)(H4,50,51,55)/t43-;;;/m0.../s1.

What are the key properties of N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide)?

N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide) has a molecular weight of 3849.93 g/mol, XLogP of 10.16, 123 rotatable bonds, 23 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[[2-[[(2R)-1-amino-3-methylsulfanyl-1-oxopropan-2-yl]amino]-2-oxoethyl]-propylamino]-2-oxoethyl]-5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-4-oxopentanamide;5-[3-(diaminomethylideneamino)propyl-[2-[[2-[2-(1H-imidazol-5-yl)ethylamino]acetyl]-[2-(3H-inden-1-yl)ethyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide;bis(5-[3-(diaminomethylideneamino)propyl-[2-[2-(3H-inden-1-yl)ethyl-[2-(pyridin-3-ylmethylamino)acetyl]amino]acetyl]amino]-N-[2-(1H-indol-3-yl)ethyl]-N-[2-[[2-(2-methylsulfanylethylamino)-2-oxoethyl]-propylamino]-2-oxoethyl]-4-oxopentanamide) is sourced from PubChem (CID 162075049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).