Linker Information
General Information of This Linker
| Linker ID |
LIN0UIVWI
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| Linker Name |
Daratumumab-I-42-0.13 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 |
C91H131N17O29S2
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| Isosmiles |
CC(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CC(C)C)C(NCC(N[C@@H](CCC(O)=O)C(N[C@@H](CC(C)C)C(N1)=O)=O)=O)=O)=O)CCNC(C2=CC=C(OC(CCOCCOCCOCCOCCOCCOCCN)=O)C=C2)=O)=O)CC3=CNC4=CC=CC=C43)=O)C)=O)CSSC[C@H](NC([C@@H](NC([C@@H]1C(C)C)=O)CC5=CNC6=CC=CC=C65)=O)C(N[C@@H]([C@H](O)C)C(O)=O)=O)=O)CC(O)=O)=O
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| InChI |
InChI=1S/C91H131N17O29S2/c1-50(2)40-66-81(119)96-47-73(111)99-64(22-23-74(112)113)82(120)103-67(41-51(3)4)87(125)107-77(52(5)6)90(128)104-69(43-58-46-95-63-17-13-11-15-61(58)63)85(123)106-72(89(127)108-78(54(8)109)91(129)130)49-139-138-48-71(105-86(124)70(44-75(114)115)98-55(9)110)88(126)97-53(7)79(117)101-68(42-57-45-94-62-16-12-10-14-60(57)62)84(122)100-65(83(121)102-66)24-27-93-80(118)56-18-20-59(21-19-56)137-76(116)25-28-131-30-32-133-34-36-135-38-39-136-37-35-134-33-31-132-29-26-92/h10-21,45-46,50-54,64-72,77-78,94-95,109H,22-44,47-49,92H2,1-9H3,(H,93,118)(H,96,119)(H,97,126)(H,98,110)(H,99,111)(H,100,122)(H,101,117)(H,102,121)(H,103,120)(H,104,128)(H,105,124)(H,106,123)(H,107,125)(H,108,127)(H,112,113)(H,114,115)(H,129,130)/t53-,54+,64-,65-,66-,67-,68-,69-,70-,71-,72-,77-,78-/m0/s1
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| InChIKey |
IFEPULCSCFUVGY-MQLIRREDSA-N
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| Pharmaceutical Properties |
Molecule Weight
|
1991.273
|
Polar area
|
678.81
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Complexity
|
.
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xlogp Value
|
-1.47
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Heavy Count
|
139
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Rot Bonds
|
46
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Hbond acc
|
29
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Hbond Donor
|
21
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Each Antibody-drug Conjugate Related to This Linker