Linker Information
General Information of This Linker
| Linker ID |
LIN0NHOJT
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| Linker Name |
Cetuximab-I-45-0.7 linker
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| Linker Type |
Unclear
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| Antibody-Linker Relation |
Unclear
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| Structure |
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| Formula |
C98H128F2N14O28
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| Isosmiles |
CC(NCC(N[C@H](C(N[C@@H](CC1=CC=C(O)C=C1)C(N[C@H](C(N[C@@H](CC2=CC=C(O)C=C2)C(N[C@H](C(N[C@@H](C(C)C)C(N[C@H](C(N[C@@H](CC3=CC=CC=C3)C(NCCOCCOCCOCCOCCC(NCC4=CC(F)=C(OC(CCOCCOCCOCCOCCOCCOCCN)=O)C(F)=C4)=O)=O)=O)CC5=CNC6=C5C=CC=C6)=O)=O)CC(O)=O)=O)=O)CC7=CNC8=C7C=CC=C8)=O)=O)CO)=O)=O
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| InChI |
InChI=1S/C98H128F2N14O28/c1-62(2)89(114-96(129)83(56-87(121)122)112-93(126)79(52-65-17-21-70(117)22-18-65)109-94(127)81(54-68-58-104-76-15-9-7-13-72(68)76)111-92(125)80(53-66-19-23-71(118)24-20-66)110-97(130)84(61-115)107-86(120)60-103-63(3)116)98(131)113-82(55-69-59-105-77-16-10-8-14-73(69)77)95(128)108-78(51-64-11-5-4-6-12-64)91(124)102-28-32-135-36-40-139-44-41-136-37-33-132-29-25-85(119)106-57-67-49-74(99)90(75(100)50-67)142-88(123)26-30-133-34-38-137-42-45-140-47-48-141-46-43-138-39-35-134-31-27-101/h4-24,49-50,58-59,62,78-84,89,104-105,115,117-118H,25-48,51-57,60-61,101H2,1-3H3,(H,102,124)(H,103,116)(H,106,119)(H,107,120)(H,108,128)(H,109,127)(H,110,130)(H,111,125)(H,112,126)(H,113,131)(H,114,129)(H,121,122)/t78-,79-,80-,81-,82-,83-,84-,89-/m0/s1
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| InChIKey |
XEIHHODNKPQXGP-GSUUAJMMSA-N
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| Pharmaceutical Properties |
Molecule Weight
|
1988.168
|
Polar area
|
594.29
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Complexity
|
.
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xlogp Value
|
1.2323
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Heavy Count
|
142
|
Rot Bonds
|
70
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Hbond acc
|
28
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Hbond Donor
|
18
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Each Antibody-drug Conjugate Related to This Linker