Payload Information
General Information of This Payload
| Payload ID | PAY0LXPGH |
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|---|---|---|---|---|---|---|
| Name | US20230285580A1 B12-B4 payload |
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| Synonyms |
YSWPAY0033
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| Structure |
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| Formula | C46H51N5O18 |
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| Isosmiles | C[C@]1(CC(CN1C(C2=C3C=C(OCCCOC4=C(OC)C=C(C5=O)C(N(C[C@]6([H])CC(CN65)=C)C(OCC7=CC=C(O[C@H]8C(O)C(O)C(O)[C@H](O8)C(O)=O)C([N+]([O-])=O)=C7)=O)=C4)C(OC)=C2)=O)=C)[C@@H](N3)O |
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| InChI |
InChI=1S/C46H51N5O18/c1-22-11-25-20-49(45(60)67-21-24-7-8-31(30(12-24)51(61)62)68-43-38(54)36(52)37(53)39(69-43)42(57)58)29-16-35(33(64-5)14-27(29)40(55)48(25)18-22)66-10-6-9-65-34-15-28-26(13-32(34)63-4)41(56)50-19-23(2)17-46(50,3)44(59)47-28/h7-8,12-16,25,36-39,43-44,47,52-54,59H,1-2,6,9-11,17-21H2,3-5H3,(H,57,58)/t25-,36?,37?,38?,39-,43+,44-,46-/m0/s1
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| InChIKey |
DZBAMPNDNMFFRV-RFUIYKIBSA-N
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| Pharmaceutical Properties | Molecule Weight |
961.931 |
Polar area |
298.93 |
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Complexity |
2580.6866 |
xlogp Value |
2.5631 |
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Heavy Count |
69 |
Rot Bonds |
14 |
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Hbond acc |
18 |
Hbond Donor |
6 |
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Each Antibody-drug Conjugate Related to This Payload