Payload Information
General Information of This Payload
| Payload ID | PAY0YIXFD |
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|---|---|---|---|---|---|---|
| Name | CN118924912A anti-HER2 ADC2 Payload |
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| Synonyms |
CN118924912A anti-HER2 ADC2 Payload
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| Structure |
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| Formula | C64H110N10O20 |
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| Isosmiles | C[C@H](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)C(OCCOCCNC([C@@H](NC([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)=O)CC2=CC=CC=C2)=O)=O |
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| InChI |
InChI=1S/C64H110N10O20/c1-15-38(6)55(73(12)63(89)53(36(2)3)70-62(88)54(37(4)5)71(9)10)48(91-13)33-51(80)74-26-19-22-45(74)58(92-14)39(7)59(85)69-44(30-41-20-17-16-18-21-41)60(86)66-25-27-93-28-29-94-64(90)40(8)67-61(87)43(23-24-52(81)82)68-49(78)31-42(65)32-50(79)72(11)34-46(76)56(83)57(84)47(77)35-75/h16-18,20-21,36-40,42-48,53-58,75-77,83-84H,15,19,22-35,65H2,1-14H3,(H,66,86)(H,67,87)(H,68,78)(H,69,85)(H,70,88)(H,81,82)/t38-,39+,40-,42?,43-,44-,45-,46-,47+,48+,53-,54-,55-,56+,57+,58+/m0/s1
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| InChIKey |
CVPBJPFJKITIAX-PTEQXSLWSA-N
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| Pharmaceutical Properties | Molecule Weight |
1339.634 |
Polar area |
428.13 |
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Complexity |
2432.152365 |
xlogp Value |
-2.1067 |
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Heavy Count |
94 |
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