Payload Information
General Information of This Payload
| Payload ID | PAY0PWLSW |
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|---|---|---|---|---|---|---|
| Name | WO2024043319A1 3.9 payload |
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| Synonyms |
PAY0427
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| Structure |
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| Formula | C59H67N11O10 |
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| Isosmiles | CC(N[C@@H](C(NCN(C(CCN1C2=CC(C#CCNC3(C)CCN(CC3)C4CCN(CC4)C5=NC(C(C6=CC=CC=C6)(OC7CC7)CO)=C8C=C(C(C9=C%10NC=C9)=CN(C)C%10=O)C=CC8=N5)=CC=C2OC)=O)C1=O)=O)CC(O)=O)=O |
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| InChI |
InChI=1S/C59H67N11O10/c1-37(72)63-47(33-51(74)75)54(76)61-36-70-50(73)21-28-69(57(70)78)48-31-38(12-17-49(48)79-4)9-8-24-62-58(2)22-29-67(30-23-58)41-19-26-68(27-20-41)56-64-46-16-13-39(45-34-66(3)55(77)52-43(45)18-25-60-52)32-44(46)53(65-56)59(35-71,80-42-14-15-42)40-10-6-5-7-11-40/h5-7,10-13,16-18,25,31-32,34,41-42,47,60,62,71H,14-15,19-24,26-30,33,35-36H2,1-4H3,(H,61,76)(H,63,72)(H,74,75)/t47-,59?/m1/s1
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| InChIKey |
HTHFAFCZMOWBLY-PWODAKHHSA-N
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| Pharmaceutical Properties | Molecule Weight |
1090.252 |
Polar area |
256.89 |
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Complexity |
3358.602169 |
xlogp Value |
4.5767 |
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Heavy Count |
80 |
Rot Bonds |
18 |
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Hbond acc |
15 |
Hbond Donor |
6 |
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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
WO2024043319A1 3.9 [Investigative]
Revealed Based on the Cell Line Data
| Experiment 1 Reporting the Activity Date of This ADC | [1] | ||||
| Efficacy Data | Half Maximal inhibitory Concentration (lC50) |
0.052 nM
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Positive CEACAM6_#84.7 expression (CEACAM6_#84.7 +++/++) | ||
| Method Description |
In vitro cytotoxicity of ADCs in AsPC-1 cells.
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| In Vitro Model | Pancreatic ductal adenocarcinoma | AsPC-1 cells | CVCL_0152 | ||