Payload Information
General Information of This Payload
| Payload ID | PAY0UBVGO |
|||||
|---|---|---|---|---|---|---|
| Name | Conjugate No.172 Payload |
|||||
| Synonyms |
Conjugate No.172 Payload
Click to Show/Hide
|
|||||
| Structure |
|
|||||
| Formula | C55H61N13O12 |
|||||
| Isosmiles | CN1C(C(N(C=C2)C3=C2C=C(OC)C=C3)=O)=CC(C4=CC=C(NC(C5=NC(NC(CCCOC6=C(OC)C=C(C7=O)C(N[C@@H](OCC(N=N8)=CN8CCOCCNC(CC(C(O)=O)N)=O)[C@@]9([H])N7CC(C9)=C)=C6)=O)=CN5C)=O)C=C4)=C1 |
|||||
| InChI |
InChI=1S/C55H61N13O12/c1-32-21-43-52(80-31-37-29-66(63-62-37)17-20-78-19-15-57-49(70)25-40(56)55(74)75)59-41-26-46(45(77-5)24-39(41)53(72)68(43)27-32)79-18-6-7-48(69)60-47-30-65(3)50(61-47)51(71)58-36-10-8-33(9-11-36)35-23-44(64(2)28-35)54(73)67-16-14-34-22-38(76-4)12-13-42(34)67/h8-14,16,22-24,26,28-30,40,43,52,59H,1,6-7,15,17-21,25,27,31,56H2,2-5H3,(H,57,70)(H,58,71)(H,60,69)(H,74,75)/t40?,43-,52-/m0/s1
|
|||||
| InChIKey |
YOABFUCZOMTQIY-WBSWNAJMSA-N
|
|||||
| Pharmaceutical Properties | Molecule Weight |
1096.172 |
Polar area |
304.57 |
||
Complexity |
3429.047154 |
xlogp Value |
4.4014 |
|||
Heavy Count |
80 |
Rot Bonds |
24 |
|||
Hbond acc |
20 |
Hbond Donor |
6 |
|||
Each Antibody-drug Conjugate Related to This Payload