Payload Information
General Information of This Payload
| Payload ID | PAY0JIXSQ |
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|---|---|---|---|---|---|---|
| Name | CN118924912A anti-HER2 ADC13 Payload |
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| Synonyms |
CN118924912A anti-HER2 ADC13 Payload
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| Structure |
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| Formula | C65H110N10O20 |
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| Isosmiles | C[C@H]([C@@H](OC)[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(N[C@@H](CC2=CC=CC=C2)C(NCCOCCOC(C3(NC([C@@H](NC(CC(N)CC(N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)=O)=O)CCC(O)=O)=O)CC3)=O)=O)=O |
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| InChI |
InChI=1S/C65H110N10O20/c1-14-39(6)55(74(11)63(90)53(37(2)3)70-62(89)54(38(4)5)72(8)9)48(92-12)34-51(81)75-27-18-21-45(75)58(93-13)40(7)59(86)69-44(31-41-19-16-15-17-20-41)60(87)67-26-28-94-29-30-95-64(91)65(24-25-65)71-61(88)43(22-23-52(82)83)68-49(79)32-42(66)33-50(80)73(10)35-46(77)56(84)57(85)47(78)36-76/h15-17,19-20,37-40,42-48,53-58,76-78,84-85H,14,18,21-36,66H2,1-13H3,(H,67,87)(H,68,79)(H,69,86)(H,70,89)(H,71,88)(H,82,83)/t39-,40+,42?,43-,44-,45-,46-,47+,48+,53-,54-,55-,56+,57+,58+/m0/s1
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| InChIKey |
IAXGGBMQZUEFRO-RPYFTGFVSA-N
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| Pharmaceutical Properties | Molecule Weight |
1351.645 |
Polar area |
428.13 |
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Complexity |
2514.862411 |
xlogp Value |
-1.9626 |
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Heavy Count |
95 |
Rot Bonds |
44 |
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Hbond acc |
21 |
Hbond Donor |
12 |
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Each Antibody-drug Conjugate Related to This Payload