Linker Information
General Information of This Linker
| Linker ID |
LIN0HIEXH
|
|||||
|---|---|---|---|---|---|---|
| Linker Name |
Anti-Her2-AL1- LP32 linker
|
|||||
| Linker Type |
Cathepsin-cleavable linker
|
|||||
| Antibody-Linker Relation |
Cleavable
|
|||||
| Structure |
|
|||||
| Formula |
C96H154N22O36
|
|||||
| Isosmiles |
NCCOCCOCCOCCN(N=N1)C2=C1C(OCC(NCCOCCOCCOCCN(CC(NCCOCCOCCC(N[C@@H](CCC(O)=O)C(N[C@H](C(N[C@@H](CCCNC(N)=O)C(NC3=CC=C(C=C3)COC(NCC(O)=O)=O)=O)=O)C(C)C)=O)=O)=O)CC(NCCOCCOCCC(N[C@@H](CCC(O)=O)C(N[C@H](C(N[C@@H](CCCNC(N)=O)C(NC4=CC=C(C=C4)COC(NCC(O)=O)=O)=O)=O)C(C)C)=O)=O)=O)=O)CCCCC2
|
|||||
| InChI |
InChI=1S/C96H154N22O36/c1-63(2)84(91(136)111-69(10-8-29-103-93(98)138)87(132)107-67-18-14-65(15-19-67)60-153-95(140)105-56-82(128)129)113-89(134)71(22-24-80(124)125)109-75(119)26-36-142-44-47-145-39-31-100-77(121)58-117(34-42-148-50-54-151-53-49-147-41-33-102-79(123)62-152-74-13-7-5-6-12-73-86(74)115-116-118(73)35-43-149-51-55-150-52-46-144-38-28-97)59-78(122)101-32-40-146-48-45-143-37-27-76(120)110-72(23-25-81(126)127)90(135)114-85(64(3)4)92(137)112-70(11-9-30-104-94(99)139)88(133)108-68-20-16-66(17-21-68)61-154-96(141)106-57-83(130)131/h14-21,63-64,69-72,74,84-85H,5-13,22-62,97H2,1-4H3,(H,100,121)(H,101,122)(H,102,123)(H,105,140)(H,106,141)(H,107,132)(H,108,133)(H,109,119)(H,110,120)(H,111,136)(H,112,137)(H,113,134)(H,114,135)(H,124,125)(H,126,127)(H,128,129)(H,130,131)(H3,98,103,138)(H3,99,104,139)/t69-,70-,71-,72-,74?,84-,85-/m0/s1
|
|||||
| InChIKey |
KDOYALOYJKCLPQ-UGBOKJLOSA-N
|
|||||
| Pharmaceutical Properties |
Molecule Weight
|
2192.406
|
Polar area
|
817.7
|
||
|
Complexity
|
.
|
xlogp Value
|
-3.2458
|
|||
|
Heavy Count
|
154
|
Rot Bonds
|
86
|
|||
|
Hbond acc
|
37
|
Hbond Donor
|
22
|
|||
Each Antibody-drug Conjugate Related to This Linker