Payload Information
General Information of This Payload
| Payload ID | PAY0UJFRE |
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|---|---|---|---|---|---|---|
| Name | Compound D104 |
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| Synonyms |
compound D104
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| Structure |
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| Formula | C58H75N9O7S |
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| Isosmiles | CN(C([C@H]1[C@@H](C2=CC=CC=C2)CCO1)=O)[C@@H](C3CCCC3)C(N[C@@H](CC4=NC(C5=CC(C(CC(C)(C)COC([C@@H]6CCCN7N6)=O)=C(N8CC)C(C=C(N9CCN(C)CC9)C=N%10)=C%10[C@H](C)OC)=C8C=C5)=CS4)C7=O)=O |
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| InChI |
InChI=1S/C58H75N9O7S/c1-8-66-48-21-20-39-29-42(48)44(52(66)43-30-40(33-59-50(43)36(2)72-7)65-26-24-63(5)25-27-65)32-58(3,4)35-74-57(71)45-19-14-23-67(62-45)55(69)46(31-49-60-47(39)34-75-49)61-54(68)51(38-17-12-13-18-38)64(6)56(70)53-41(22-28-73-53)37-15-10-9-11-16-37/h9-11,15-16,20-21,29-30,33-34,36,38,41,45-46,51,53,62H,8,12-14,17-19,22-28,31-32,35H2,1-7H3,(H,61,68)/t36-,41+,45-,46-,51-,53+/m0/s1
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| InChIKey |
YVVRMJOKYQUCNA-RCJLCGKJSA-N
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| Pharmaceutical Properties | Molecule Weight |
1042.361 |
Polar area |
163.7 |
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Complexity |
2793.471546 |
xlogp Value |
7.5442 |
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Heavy Count |
75 |
Rot Bonds |
11 |
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Hbond acc |
14 |
Hbond Donor |
2 |
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Each Antibody-drug Conjugate Related to This Payload