Payload Information
General Information of This Payload
| Payload ID | PAY0ZRPIV |
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|---|---|---|---|---|---|---|
| Name | Clezutoclax |
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| Synonyms |
Clezutoclax
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| Target(s) | Bcl-2-like protein 1 (BCL2L1) | |||||
| Structure |
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| Formula | C46H55N7O6S |
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| Isosmiles | Cc1c(-c2ccc(N3CCc4cccc(C(=O)Nc5nc6ccccc6s5)c4C3)nc2C(=O)O)cnn1CC12CC3(C)CC(C)(C1)CC(OCCNCC[C@@H](O)CO)(C3)C2 |
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| InChI |
InChI=1S/C46H55N7O6S/c1-29-34(19-48-53(29)28-45-23-43(2)22-44(3,24-45)26-46(25-43,27-45)59-18-16-47-15-13-31(55)21-54)32-11-12-38(50-39(32)41(57)58)52-17-14-30-7-6-8-33(35(30)20-52)40(56)51-42-49-36-9-4-5-10-37(36)60-42/h4-12,19,31,47,54-55H,13-18,20-28H2,1-3H3,(H,57,58)(H,49,51,56)/t31-,43?,44?,45?,46?/m1/s1
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| InChIKey |
JDRWPKNPESVAQP-OBRWPCRASA-N
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| Pharmaceutical Properties | Molecule Weight |
834.056 |
Polar area |
174.96 |
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Complexity |
833.3934535 |
xlogp Value |
6.84512 |
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Heavy Count |
60 |
Rot Bonds |
15 |
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Hbond acc |
12 |
Hbond Donor |
5 |
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Each Antibody-drug Conjugate Related to This Payload