Linker Information
General Information of This Linker
| Linker ID |
LIN0JZNZU
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| Linker Name |
Daratumumab-I-43-0.26 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](CSSC[C@H](NC([C@@H](NC([C@@H]1C(C)C)=O)CC2=CNC3=CC=CC=C32)=O)C(N[C@@H]([C@H](O)C)C(O)=O)=O)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)CC(NCC4=CC=C(OC(CCOCCOCCOCCOCCOCCOCCN)=O)C=C4)=O)=O)CC5=CNC6=CC=CC=C65)=O)C)=O)=O)CC(O)=O)=O
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| InChI |
InChI=1S/C91H131N17O29S2/c1-50(2)38-65-81(119)96-47-74(112)99-64(22-23-75(113)114)82(120)102-66(39-51(3)4)87(125)107-78(52(5)6)90(128)104-68(41-58-46-94-63-17-13-11-15-61(58)63)84(122)106-72(89(127)108-79(54(8)109)91(129)130)49-139-138-48-71(105-86(124)70(43-76(115)116)98-55(9)110)88(126)97-53(7)80(118)100-67(40-57-45-93-62-16-12-10-14-60(57)62)83(121)103-69(85(123)101-65)42-73(111)95-44-56-18-20-59(21-19-56)137-77(117)24-26-131-28-30-133-32-34-135-36-37-136-35-33-134-31-29-132-27-25-92/h10-21,45-46,50-54,64-72,78-79,93-94,109H,22-44,47-49,92H2,1-9H3,(H,95,111)(H,96,119)(H,97,126)(H,98,110)(H,99,112)(H,100,118)(H,101,123)(H,102,120)(H,103,121)(H,104,128)(H,105,124)(H,106,122)(H,107,125)(H,108,127)(H,113,114)(H,115,116)(H,129,130)/t53-,54+,64-,65-,66-,67-,68-,69-,70-,71-,72-,78-,79-/m0/s1
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| InChIKey |
UEBKMCMAVSSWOD-PTWCJYQJSA-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
|
-1.5836
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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
