4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine

C130H207N49O35 — CID 161293086

IUPAC4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine
SMILESC1CCNCC1.O=C(O)CCC(CCC(=O)O)(CCC(=O)O)NC(=O)CCC(CCC(=O)NC(CCC(=O)O)(CCC(=O)O)CCC(=O)O)(CCC(=O)NC(CCC(=O)O)(CCC(=O)O)CCC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21.[N-]=[N+]=NCCCN.[N-]=[N+]=NCCCNC(=O)CCC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])NC(=O)CCC(N)(CCC(=O)NC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NCCCN=[N+]=[N-]
InChIInChI=1S/C67H116N40O12.C55H72N4O23.C5H11N.C3H8N4/c68-64(22-10-61(117)96-65(25-13-52(108)78-34-1-43-87-99-69,26-14-53(109)79-35-2-44-88-100-70)27-15-54(110)80-36-3-45-89-101-71,23-11-62(118)97-66(28-16-55(111)81-37-4-46-90-102-72,29-17-56(112)82-38-5-47-91-103-73)30-18-57(113)83-39-6-48-92-104-74)24-12-63(119)98-67(31-19-58(114)84-40-7-49-93-105-75,32-20-59(115)85-41-8-50-94-106-76)33-21-60(116)86-42-9-51-95-107-77;60-39(56-52(24-12-42(63)64,25-13-43(65)66)26-14-44(67)68)9-21-55(22-10-40(61)57-53(27-15-45(69)70,28-16-46(71)72)29-17-47(73)74,23-11-41(62)58-54(30-18-48(75)76,31-19-49(77)78)32-20-50(79)80)59-51(81)82-33-38-36-7-3-1-5-34(36)35-6-2-4-8-37(35)38;1-2-4-6-5-3-1;4-2-1-3-6-7-5/h1-51,68H2,(H,78,108)(H,79,109)(H,80,110)(H,81,111)(H,82,112)(H,83,113)(H,84,114)(H,85,115)(H,86,116)(H,96,117)(H,97,118)(H,98,119);1-8,38H,9-33H2,(H,56,60)(H,57,61)(H,58,62)(H,59,81)(H,63,64)(H,65,66)(H,67,68)(H,69,70)(H,71,72)(H,73,74)(H,75,76)(H,77,78)(H,79,80);6H,1-5H2;1-4H2
InChIKeyVGPRUMBGFYYEKQ-UHFFFAOYSA-N
MW3016.39 g/mol
LogP14.32
Rot. Bonds120

About 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine

4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine (PubChem CID 161293086) has the molecular formula C130H207N49O35 and a molecular weight of 3016.39 g/mol. Its IUPAC name is 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine.

Molecular Properties

Compound Name4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine
PubChem CID161293086
Molecular FormulaC130H207N49O35
Molecular Weight3016.39 g/mol
Exact Mass3014.59
IUPAC Name4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine
SMILESC1CCNCC1.O=C(O)CCC(CCC(=O)O)(CCC(=O)O)NC(=O)CCC(CCC(=O)NC(CCC(=O)O)(CCC(=O)O)CCC(=O)O)(CCC(=O)NC(CCC(=O)O)(CCC(=O)O)CCC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21.[N-]=[N+]=NCCCN.[N-]=[N+]=NCCCNC(=O)CCC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])NC(=O)CCC(N)(CCC(=O)NC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NCCCN=[N+]=[N-]
InChIInChI=1S/C67H116N40O12.C55H72N4O23.C5H11N.C3H8N4/c68-64(22-10-61(117)96-65(25-13-52(108)78-34-1-43-87-99-69,26-14-53(109)79-35-2-44-88-100-70)27-15-54(110)80-36-3-45-89-101-71,23-11-62(118)97-66(28-16-55(111)81-37-4-46-90-102-72,29-17-56(112)82-38-5-47-91-103-73)30-18-57(113)83-39-6-48-92-104-74)24-12-63(119)98-67(31-19-58(114)84-40-7-49-93-105-75,32-20-59(115)85-41-8-50-94-106-76)33-21-60(116)86-42-9-51-95-107-77;60-39(56-52(24-12-42(63)64,25-13-43(65)66)26-14-44(67)68)9-21-55(22-10-40(61)57-53(27-15-45(69)70,28-16-46(71)72)29-17-47(73)74,23-11-41(62)58-54(30-18-48(75)76,31-19-49(77)78)32-20-50(79)80)59-51(81)82-33-38-36-7-3-1-5-34(36)35-6-2-4-8-37(35)38;1-2-4-6-5-3-1;4-2-1-3-6-7-5/h1-51,68H2,(H,78,108)(H,79,109)(H,80,110)(H,81,111)(H,82,112)(H,83,113)(H,84,114)(H,85,115)(H,86,116)(H,96,117)(H,97,118)(H,98,119);1-8,38H,9-33H2,(H,56,60)(H,57,61)(H,58,62)(H,59,81)(H,63,64)(H,65,66)(H,67,68)(H,69,70)(H,71,72)(H,73,74)(H,75,76)(H,77,78)(H,79,80);6H,1-5H2;1-4H2
InChIKeyVGPRUMBGFYYEKQ-UHFFFAOYSA-N
XLogP14.32
TPSA1362.20 Ų
H-Bond Donors28
H-Bond Acceptors39
Rotatable Bonds120
Heavy Atoms214
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003016.39
LogP ≤ 514.32
H-Bond Donors ≤ 528
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine with MolForge

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Launch Full Analysis

Related Compounds

(2S)-5-azido-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methylpentanoic acid
CID 59827246
9H-fluoren-9-ylmethyl N-[1,7-dioxo-4-[3-oxo-3-[2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethylamino]propyl]-1,7-bis[2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethylamino]heptan-4-yl]carbamate
CID 11446109
2-(2-aminoethoxy)acetic acid;bis(2,3,4,5,6-pentafluorophenyl) 4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[3-oxo-4-(2,3,4,5,6-pentafluorophenyl)butyl]heptanedioate;2-[2-[[7-[2-(carboxymethoxy)ethylamino]-4-[3-[2-(carboxymethoxy)ethylamino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]ethoxy]acetic acid
CID 158332516
4-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)acetyl]amino]butanoic acid
CID 118448290
9H-fluoren-9-ylmethyl N-[(2S)-4-amino-1-(5-azidopentylamino)-1,4-dioxobutan-2-yl]carbamate
CID 11102647
9H-fluoren-9-ylmethyl N-[(5S)-10-azido-5-methyl-6-oxodecyl]carbamate
CID 161115068
9H-fluoren-9-ylmethyl N-(12-aminododecyl)carbamate
CID 139208955
2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)propanoylamino]acetic acid
CID 162720748
(2S)-6-azido-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid
CID 25146063
9H-fluoren-9-ylmethyl N-(9-aminononyl)carbamate;hydrochloride
CID 139208949
3-azidopropyl-[3-azidopropyl(dimethyl)silyl]oxy-dimethylsilane;3-azidopropyl-chloro-dimethylsilane;3-[[3-azidopropyl(dimethyl)silyl]oxy-dimethylsilyl]propan-1-amine;9H-fluoren-9-ylmethyl 5-[[3-azidopropyl(dimethyl)silyl]oxy-dimethylsilyl]pentanoate;9H-fluoren-9-ylmethyl N-[3-[chloro(dimethyl)silyl]propyl]carbamate;9H-fluoren-9-ylmethyl 5-[[[5-(9H-fluoren-9-ylmethoxy)-5-oxopentyl]-dimethylsilyl]oxy-dimethylsilyl]pentanoate
CID 158145644
2-[4-(9H-fluoren-9-ylmethoxycarbonylamino)butylamino]acetic acid;hydrochloride
CID 134830437

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine?
The IUPAC name of 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine (CID 161293086) is 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine.
What is the SMILES notation for 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine?
The canonical SMILES for 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine is C1CCNCC1.O=C(O)CCC(CCC(=O)O)(CCC(=O)O)NC(=O)CCC(CCC(=O)NC(CCC(=O)O)(CCC(=O)O)CCC(=O)O)(CCC(=O)NC(CCC(=O)O)(CCC(=O)O)CCC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21.[N-]=[N+]=NCCCN.[N-]=[N+]=NCCCNC(=O)CCC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])NC(=O)CCC(N)(CCC(=O)NC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NC(CCC(=O)NCCCN=[N+]=[N-])(CCC(=O)NCCCN=[N+]=[N-])CCC(=O)NCCCN=[N+]=[N-].
What is the InChIKey of 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine?
The InChIKey is VGPRUMBGFYYEKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H116N40O12.C55H72N4O23.C5H11N.C3H8N4/c68-64(22-10-61(117)96-65(25-13-52(108)78-34-1-43-87-99-69,26-14-53(109)79-35-2-44-88-100-70)27-15-54(110)80-36-3-45-89-101-71,23-11-62(118)97-66(28-16-55(111)81-37-4-46-90-102-72,29-17-56(112)82-38-5-47-91-103-73)30-18-57(113)83-39-6-48-92-104-74)24-12-63(119)98-67(31-19-58(114)84-40-7-49-93-105-75,32-20-59(115)85-41-8-50-94-106-76)33-21-60(116)86-42-9-51-95-107-77;60-39(56-52(24-12-42(63)64,25-13-43(65)66)26-14-44(67)68)9-21-55(22-10-40(61)57-53(27-15-45(69)70,28-16-46(71)72)29-17-47(73)74,23-11-41(62)58-54(30-18-48(75)76,31-19-49(77)78)32-20-50(79)80)59-51(81)82-33-38-36-7-3-1-5-34(36)35-6-2-4-8-37(35)38;1-2-4-6-5-3-1;4-2-1-3-6-7-5/h1-51,68H2,(H,78,108)(H,79,109)(H,80,110)(H,81,111)(H,82,112)(H,83,113)(H,84,114)(H,85,115)(H,86,116)(H,96,117)(H,97,118)(H,98,119);1-8,38H,9-33H2,(H,56,60)(H,57,61)(H,58,62)(H,59,81)(H,63,64)(H,65,66)(H,67,68)(H,69,70)(H,71,72)(H,73,74)(H,75,76)(H,77,78)(H,79,80);6H,1-5H2;1-4H2.
What are the key properties of 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine?
4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine has a molecular weight of 3016.39 g/mol, XLogP of 14.32, 120 rotatable bonds, 28 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N'-bis[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]-4-[3-[[1,7-bis(3-azidopropylamino)-4-[3-(3-azidopropylamino)-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-3-oxopropyl]heptanediamide;3-azidopropan-1-amine;4-(2-carboxyethyl)-4-[[7-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-4-[3-[[1,5-dicarboxy-3-(2-carboxyethyl)pentan-3-yl]amino]-3-oxopropyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-oxoheptanoyl]amino]heptanedioic acid;piperidine is sourced from PubChem (CID 161293086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).