Linker Information
General Information of This Linker
| Linker ID |
LIN0PKGIS
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| Linker Name |
CN117750982A ADC60 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 |
C83H116N26O9
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| Isosmiles |
C=CC1=NC(NCCCC(NCCN(CC(NCCN(CCN(CC(NCC#C)=O)CCN(CCNC(CN(CCNC(CCCNC2=NC(C=C)=CC(C=C)=N2)=O)CCNC(CCCNC3=NC(C=C)=CC(C=C)=N3)=O)=O)CC(NCC#C)=O)CC(NCC#C)=O)=O)CCNC(CCCNC4=NC(C=C)=CC(C=C)=N4)=O)=O)=NC(C=C)=C1
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| InChI |
InChI=1S/C83H116N26O9/c1-12-31-84-75(114)60-107(48-42-91-78(117)58-105(44-38-87-71(110)27-23-34-93-80-97-63(15-4)54-64(16-5)98-80)45-39-88-72(111)28-24-35-94-81-99-65(17-6)55-66(18-7)100-81)50-52-109(62-77(116)86-33-14-3)53-51-108(61-76(115)85-32-13-2)49-43-92-79(118)59-106(46-40-89-73(112)29-25-36-95-82-101-67(19-8)56-68(20-9)102-82)47-41-90-74(113)30-26-37-96-83-103-69(21-10)57-70(22-11)104-83/h1-3,15-22,54-57H,4-11,23-53,58-62H2,(H,84,114)(H,85,115)(H,86,116)(H,87,110)(H,88,111)(H,89,112)(H,90,113)(H,91,117)(H,92,118)(H,93,97,98)(H,94,99,100)(H,95,101,102)(H,96,103,104)
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| InChIKey |
ZEOHKDWRIUPKGX-UHFFFAOYSA-N
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| Pharmaceutical Properties |
Molecule Weight
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1622.014
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Polar area
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429.34
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Complexity
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3473.678105
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xlogp Value
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1.315
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Heavy Count
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118
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Rot Bonds
|
65
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Hbond acc
|
26
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Hbond Donor
|
13
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Each Antibody-drug Conjugate Related to This Linker
