Payload Information
General Information of This Payload
| Payload ID | PAY0HTYNN |
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|---|---|---|---|---|---|---|
| Name | CN118924912A anti-HER2 ADC1 Payload |
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| Synonyms |
CN118924912A anti-HER2 ADC1 Payload
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| Structure |
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| Formula | C66H114N10O20 |
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| Isosmiles | CC([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)C |
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| InChI |
InChI=1S/C66H114N10O20/c1-16-40(8)57(75(13)65(91)54(37(2)3)71-64(90)56(39(6)7)73(10)11)49(93-14)34-52(82)76-27-20-23-46(76)60(94-15)41(9)61(87)70-45(31-42-21-18-17-19-22-42)62(88)68-26-28-95-29-30-96-66(92)55(38(4)5)72-63(89)44(24-25-53(83)84)69-50(80)32-43(67)33-51(81)74(12)35-47(78)58(85)59(86)48(79)36-77/h17-19,21-22,37-41,43-49,54-60,77-79,85-86H,16,20,23-36,67H2,1-15H3,(H,68,88)(H,69,80)(H,70,87)(H,71,90)(H,72,89)(H,83,84)/t40-,41+,43?,44-,45-,46-,47-,48+,49+,54-,55-,56-,57-,58+,59+,60+/m0/s1
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| InChIKey |
DBEKORYQKKXCSQ-IHZWCZRASA-N
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| Pharmaceutical Properties | Molecule Weight |
1367.688 |
Polar area |
428.13 |
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Complexity |
2483.328186 |
xlogp Value |
-1.4706 |
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Heavy Count |
96 |
Rot Bonds |
45 |
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Hbond acc |
21 |
Hbond Donor |
12 |
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Each Antibody-drug Conjugate Related to This Payload