Linker Information
General Information of This Linker
| Linker ID |
LIN0JYUNG
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| Linker Name |
Cetuximab-I-40-0.69 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 |
C93H119FN14O26
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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(NCCOCCOCCNC(C4=CC=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/C93H119FN14O26/c1-58(2)84(108-91(123)78(53-82(114)115)106-88(120)74(48-61-17-22-66(111)23-18-61)103-89(121)76(51-64-54-99-71-15-9-7-13-68(64)71)105-87(119)75(49-62-19-24-67(112)25-20-62)104-92(124)79(57-109)101-81(113)56-98-59(3)110)93(125)107-77(52-65-55-100-72-16-10-8-14-69(65)72)90(122)102-73(47-60-11-5-4-6-12-60)86(118)97-30-34-129-38-37-128-33-29-96-85(117)63-21-26-80(70(94)50-63)134-83(116)27-31-126-35-39-130-41-43-132-45-46-133-44-42-131-40-36-127-32-28-95/h4-26,50,54-55,58,73-79,84,99-100,109,111-112H,27-49,51-53,56-57,95H2,1-3H3,(H,96,117)(H,97,118)(H,98,110)(H,101,113)(H,102,122)(H,103,121)(H,104,124)(H,105,119)(H,106,120)(H,107,125)(H,108,123)(H,114,115)/t73-,74-,75-,76-,77-,78-,79-,84+/m0/s1
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| InChIKey |
XWIISNXQRHOOQN-LNGMWGNJSA-N
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| Pharmaceutical Properties |
Molecule Weight
|
1868.045
|
Polar area
|
575.83
|
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Complexity
|
.
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xlogp Value
|
0.7835
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Heavy Count
|
134
|
Rot Bonds
|
63
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Hbond acc
|
26
|
Hbond Donor
|
18
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Each Antibody-drug Conjugate Related to This Linker