Payload Information
General Information of This Payload
| Payload ID | PAY0LQWXW |
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|---|---|---|---|---|---|---|
| Name | AF647 |
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| Synonyms |
AF647
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| Formula | C36H46N2O14S4 |
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| Isosmiles | CC1(C)C2=C([N+](CCCS(=O)(O)=O)=C1/C=C/C=C/C=C3C(C)(CCCCCC(O)=O)C4=C(C=CC(S(=O)(O)=O)=C4)N/3CCCS(=O)([O-])=O)C=CC(S(=O)(O)=O)=C2 |
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| InChI |
InChI=1S/C36H46N2O14S4/c1-35(2)28-24-26(55(47,48)49)15-17-30(28)37(20-10-22-53(41,42)43)32(35)12-6-4-7-13-33-36(3,19-9-5-8-14-34(39)40)29-25-27(56(50,51)52)16-18-31(29)38(33)21-11-23-54(44,45)46/h4,6-7,12-13,15-18,24-25H,5,8-11,14,19-23H2,1-3H3,(H4-,39,40,41,42,43,44,45,46,47,48,49,50,51,52)
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| InChIKey |
YZKPBELIKPDYRV-UHFFFAOYSA-N
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| Pharmaceutical Properties | Molecule Weight |
859.032 |
Polar area |
263.86 |
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Complexity |
2358.297492 |
xlogp Value |
4.5787 |
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Heavy Count |
56 |
Rot Bonds |
19 |
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Hbond acc |
11 |
Hbond Donor |
4 |
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Each Antibody-drug Conjugate Related to This Payload