Payload Information
General Information of This Payload
| Payload ID | PAY0TMHKI |
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|---|---|---|---|---|---|---|
| Name | CN118924912A anti-HER2 ADC4 Payload |
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| Synonyms |
CN118924912A anti-HER2 ADC4 Payload
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| Structure |
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| Formula | C63H106N10O20 |
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| Isosmiles | C[C@H](NC([C@@H](NC(CC(N)CC(N[C@H]([C@@H](O)[C@H](O)[C@H]1CO)C(O1)O)=O)=O)CCC(O)=O)=O)C(OCCOCCNC([C@@H](NC([C@@H]([C@@H](OC)[C@@H]2CCCN2C(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)CC3=CC=CC=C3)=O)=O |
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| InChI |
InChI=1S/C63H106N10O20/c1-14-36(6)53(72(11)61(86)50(34(2)3)70-60(85)52(35(4)5)71(9)10)44(89-12)32-48(77)73-25-18-21-43(73)56(90-13)37(7)57(82)68-42(29-39-19-16-15-17-20-39)58(83)65-24-26-91-27-28-92-62(87)38(8)66-59(84)41(22-23-49(78)79)67-46(75)30-40(64)31-47(76)69-51-55(81)54(80)45(33-74)93-63(51)88/h15-17,19-20,34-38,40-45,50-56,63,74,80-81,88H,14,18,21-33,64H2,1-13H3,(H,65,83)(H,66,84)(H,67,75)(H,68,82)(H,69,76)(H,70,85)(H,78,79)/t36-,37+,38-,40?,41-,42-,43-,44+,45+,50-,51+,52-,53-,54+,55+,56+,63?/m0/s1
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| InChIKey |
XQFJFPVZMUJWKR-URNAUNQYSA-N
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| Pharmaceutical Properties | Molecule Weight |
1323.591 |
Polar area |
425.92 |
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Complexity |
2449.860773 |
xlogp Value |
-2.0849 |
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Heavy Count |
93 |
Rot Bonds |
40 |
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Hbond acc |
21 |
Hbond Donor |
12 |
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Each Antibody-drug Conjugate Related to This Payload