Linker Information
General Information of This Linker
| Linker ID |
LIN0MXBSX
|
|||||
|---|---|---|---|---|---|---|
| Linker Name |
aHer2- (BL3b-LP1)<sub>7.5</sub> Linker
|
|||||
| Linker Type |
Cathepsin-cleavable linker
|
|||||
| Antibody-Linker Relation |
Cleavable
|
|||||
| Structure |
|
|||||
| Formula |
C108H182N22O34
|
|||||
| Isosmiles |
O=C(C)NCCOCCOCCOCCN(CC(NCCOCCOCCOCCN(N=N1)C2=C1C(OCC(NCCOCCOCCOCCOCCC(N[C@H](C(N[C@@H](CCCNC(N)=O)C(NC3=CC=C(CO)C=C3)=O)=O)C(C)C)=O)=O)CCCCC2)=O)CC(NCCOCCOCCOCCN(N=N4)C5=C4C(OCC(NCCOCCOCCOCCOCCC(N[C@@H](C(C)C)C(N[C@@H](CCCNC(N)=O)C(NC6=CC=C(CO)C=C6)=O)=O)=O)=O)CCCCC5)=O
|
|||||
| InChI |
InChI=1S/C108H182N22O34/c1-80(2)99(105(142)120-87(14-12-30-116-107(109)144)103(140)118-85-24-20-83(76-131)21-25-85)122-93(134)28-40-146-50-60-156-70-72-161-65-55-151-45-35-114-97(138)78-163-91-18-10-6-8-16-89-101(91)124-126-129(89)38-48-154-58-68-159-63-53-149-43-33-112-95(136)74-128(37-47-153-57-67-158-62-52-148-42-32-111-82(5)133)75-96(137)113-34-44-150-54-64-160-69-59-155-49-39-130-90-17-9-7-11-19-92(102(90)125-127-130)164-79-98(139)115-36-46-152-56-66-162-73-71-157-61-51-147-41-29-94(135)123-100(81(3)4)106(143)121-88(15-13-31-117-108(110)145)104(141)119-86-26-22-84(77-132)23-27-86/h20-27,80-81,87-88,91-92,99-100,131-132H,6-19,28-79H2,1-5H3,(H,111,133)(H,112,136)(H,113,137)(H,114,138)(H,115,139)(H,118,140)(H,119,141)(H,120,142)(H,121,143)(H,122,134)(H,123,135)(H3,109,116,144)(H3,110,117,145)/t87-,88-,91?,92?,99-,100-/m0/s1
|
|||||
| InChIKey |
WWXNDMGYTZCKEW-UTDVMMPKSA-N
|
|||||
| Pharmaceutical Properties |
Molecule Weight
|
2332.764
|
Polar area
|
710.83
|
||
|
Complexity
|
.
|
xlogp Value
|
-0.7063
|
|||
|
Heavy Count
|
164
|
Rot Bonds
|
98
|
|||
|
Hbond acc
|
41
|
Hbond Donor
|
17
|
|||
Each Antibody-drug Conjugate Related to This Linker