Linker Information
General Information of This Linker
| Linker ID |
LIN0AKQKQ
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| Linker Name |
CN119072334A+Formula 8+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 |
C97H127N17O26
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| Isosmiles |
CC(C)C(NC(CC[C@H](NC([C@@H](NC(C1=CC=C(C=C1)C(C(C=C)C=C)=O)=O)CCC(NC(C(C)C)C(N[C@H](C(NC2=CC=C(CO)C=C2)=O)CCCNC(N)=O)=O)=O)=O)C(N[C@@H](CCC(NCCOCCOC)=O)C(NCCOCCOC)=O)=O)=O)C(NC(C(NC3=CC=C(COC(O[C@](C(C=C4C5=C(C(CC)=C(C=C(O)C=C6)C6=N5)CN74)=C(C7=O)CO8)(CC)C8=O)=O)C=C3)=O)CCCNC(N)=O)=O
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| InChI |
InChI=1S/C97H127N17O26/c1-11-59(12-2)83(120)60-23-25-61(26-24-60)84(121)107-74(34-37-78(118)112-80(55(5)6)90(127)110-71(17-15-39-102-94(98)131)86(123)104-62-27-19-57(52-115)20-28-62)88(125)109-75(89(126)108-73(85(122)101-42-44-137-48-46-135-10)33-36-77(117)100-41-43-136-47-45-134-9)35-38-79(119)113-81(56(7)8)91(128)111-72(18-16-40-103-95(99)132)87(124)105-63-29-21-58(22-30-63)53-139-96(133)140-97(14-4)69-50-76-82-67(51-114(76)92(129)68(69)54-138-93(97)130)65(13-3)66-49-64(116)31-32-70(66)106-82/h11-12,19-32,49-50,55-56,59,71-75,80-81,115-116H,1-2,13-18,33-48,51-54H2,3-10H3,(H,100,117)(H,101,122)(H,104,123)(H,105,124)(H,107,121)(H,108,126)(H,109,125)(H,110,127)(H,111,128)(H,112,118)(H,113,119)(H3,98,102,131)(H3,99,103,132)/t71-,72?,73-,74-,75-,80?,81?,97-/m0/s1
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| InChIKey |
PRKRPBICJFZWDI-PGFPGQJTSA-N
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| Pharmaceutical Properties |
Molecule Weight
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1947.176
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Polar area
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621.51
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Complexity
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.
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xlogp Value
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3.7645
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Heavy Count
|
140
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Rot Bonds
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58
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Hbond acc
|
28
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Hbond Donor
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17
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Each Antibody-drug Conjugate Related to This Linker
