Payload Information
General Information of This Payload
| Payload ID | PAY0SRDUZ |
|||||
|---|---|---|---|---|---|---|
| Name | CN118924912A anti-HER2 ADC9 Payload |
|||||
| Synonyms |
CN118924912A anti-HER2 ADC9 Payload
Click to Show/Hide
|
|||||
| Structure |
|
|||||
| Formula | C64H110N10O18 |
|||||
| Isosmiles | CO[C@@H]([C@@H]1CCCN1C(C[C@@H](OC)[C@@H](N(C([C@@H](NC([C@@H](N(C)C)C(C)C)=O)C(C)C)=O)C)[C@@H](C)CC)=O)[C@H](C(N[C@@H](CC2=CC=CC=C2)C(NCCOCCOC([C@@H](NC(C(NC(CC[C@H](N)C(NCCOCCOCCOC)=O)=O)CCC(O)=O)=O)C)=O)=O)=O)C |
|||||
| InChI |
InChI=1S/C64H110N10O18/c1-15-42(6)56(73(11)63(84)54(40(2)3)71-62(83)55(41(4)5)72(9)10)50(87-13)39-52(76)74-29-19-22-49(74)57(88-14)43(7)58(79)70-48(38-45-20-17-16-18-21-45)60(81)67-28-31-90-36-37-92-64(85)44(8)68-61(82)47(24-26-53(77)78)69-51(75)25-23-46(65)59(80)66-27-30-89-34-35-91-33-32-86-12/h16-18,20-21,40-44,46-50,54-57H,15,19,22-39,65H2,1-14H3,(H,66,80)(H,67,81)(H,68,82)(H,69,75)(H,70,79)(H,71,83)(H,77,78)/t42-,43+,44-,46-,47?,48-,49-,50+,54-,55-,56-,57+/m0/s1
|
|||||
| InChIKey |
VPVKCVPKWWHOHZ-FYMKGLEESA-N
|
|||||
| Pharmaceutical Properties | Molecule Weight |
1307.636 |
Polar area |
363.46 |
||
Complexity |
2308.675179 |
xlogp Value |
0.7948 |
|||
Heavy Count |
92 |
Rot Bonds |
47 |
|||
Hbond acc |
19 |
Hbond Donor |
8 |
|||
Each Antibody-drug Conjugate Related to This Payload