Payload Information
General Information of This Payload
| Payload ID | PAY0KTUVX |
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|---|---|---|---|---|---|---|
| Name | CL202203715A1 P46 |
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| Synonyms |
CL202203715A1 P46
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| Structure |
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| Formula | C38H61N5O8S2 |
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| Isosmiles | CN1CCCC[C@@H]1C(NC)=O.CCCCCCN(C(C[C@@H](C)CC)=O)[C@@H](C(C)C)C[C@@H](OC(C)=O)C2=NC(C(NS(=O)(C3=CC=C(C=C3)O)=O)=O)=CS2 |
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| InChI |
InChI=1S/C30H45N3O7S2.C8H16N2O/c1-7-9-10-11-16-33(28(36)17-21(5)8-2)26(20(3)4)18-27(40-22(6)34)30-31-25(19-41-30)29(37)32-42(38,39)24-14-12-23(35)13-15-24;1-9-8(11)7-5-3-4-6-10(7)2/h12-15,19-21,26-27,35H,7-11,16-18H2,1-6H3,(H,32,37);7H,3-6H2,1-2H3,(H,9,11)/t21-,26+,27+;7-/m01/s1
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| InChIKey |
ZMJKNYQCUGOJFV-MBDSSUBPSA-N
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| Pharmaceutical Properties | Molecule Weight |
780.067 |
Polar area |
175.31 |
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Complexity |
1497.588452 |
xlogp Value |
6.0481 |
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Heavy Count |
53 |
Rot Bonds |
18 |
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Hbond acc |
11 |
Hbond Donor |
3 |
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Each Antibody-drug Conjugate Related to This Payload
Full Information of The Activity Data of The ADC(s) Related to This Payload
TRSQ-ZP3A-LP25 [Investigative]
Revealed Based on the Cell Line Data
| Experiment 1 Reporting the Activity Date of This ADC | [1] | ||||
| Efficacy Data | Half Maximal Effective Concentration (EC50) |
1.329 nM
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Positive HER2 expression (HER2+++/++) | ||
| Method Description |
The anti-proliferation test was carried out with SK-BR-3 human breast cancer cell line. Cells were grown in McCoy's 5a medium supplemented with 29% FBS,penicillin/streptomycin and L-glutamine.
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| In Vitro Model | Breast adenocarcinoma | SK-BR-3 cells | CVCL_0033 | ||