Payload Information
General Information of This Payload
| Payload ID | PAY0AKUNH |
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|---|---|---|---|---|---|---|
| Name | AZ13599185 |
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| Synonyms |
AZ13599185
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| Target(s) | Microtubule (MT) | |||||
| Structure |
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| Formula | C40H62N6O7S |
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| Isosmiles | CCC(C)C(NC(=O)C1CC(C)CCN1C)C(=O)N(CC)C(CC(OC(C)=O)c1nc(C(=O)NC(Cc2ccc(N)cc2)CC(C)C(=O)O)cs1)C(C)C |
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| InChI |
InChI=1S/C40H62N6O7S/c1-10-25(6)35(44-37(49)33-18-24(5)16-17-45(33)9)39(50)46(11-2)32(23(3)4)21-34(53-27(8)47)38-43-31(22-54-38)36(48)42-30(19-26(7)40(51)52)20-28-12-14-29(41)15-13-28/h12-15,22-26,30,32-35H,10-11,16-21,41H2,1-9H3,(H,42,48)(H,44,49)(H,51,52)
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| InChIKey |
XGSFLELSPQDOPW-UHFFFAOYSA-N
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| Pharmaceutical Properties | Molecule Weight |
771.038 |
Polar area |
184.26 |
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Complexity |
54 |
xlogp Value |
5.3058 |
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Heavy Count |
54 |
Rot Bonds |
19 |
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Hbond acc |
10 |
Hbond Donor |
4 |
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The activity data of This Payload
| Standard Type | Value | Units | Cell line | Disease Model | Cell line ID | Reference |
|---|---|---|---|---|---|---|
| Half Maximal Cell Growth Inhibitory Concentration (GI50) | 0.62 | nM |
HCT 116 cells
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Colon cancer
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[1] | |
| Half Maximal Cell Growth Inhibitory Concentration (GI50) | 0.71 | nM |
DU145 cells
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Prostate carcinoma
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[1] | |
| Half Maximal Cell Growth Inhibitory Concentration (GI50) | 1.14 | nM |
MDA-MB-231 cells
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Breast adenocarcinoma
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[1] |
Each Antibody-drug Conjugate Related to This Payload
References
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