Payload Information
General Information of This Payload
| Payload ID | PAY0EKZGV |
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|---|---|---|---|---|---|---|
| Name | IRDye800CW |
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| Synonyms |
IRDye800CW
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| Formula | C46H51N2Na3O15S4 |
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| Isosmiles | CC1(C)C2=CC([Na])=CC=C2N(CCCCCC(O)=O)/C1=C/C=C3CCCC(/C=C/C4=[N+](CCCCS(=O)([O-])=O)C(C=CC([Na])=C5)=C5C4(C)C)=C\3OC6=CC=C([Na])C=C6.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O |
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| InChI |
InChI=1S/C46H51N2O6S.3Na.3O3S/c1-45(2)37-22-10-12-24-39(37)47(31-14-6-9-26-43(49)50)41(45)29-27-34-18-17-19-35(44(34)54-36-20-7-5-8-21-36)28-30-42-46(3,4)38-23-11-13-25-40(38)48(42)32-15-16-33-55(51,52)53;;;;3*1-4(2)3/h7-8,12-13,20-25,27-30H,6,9,14-19,26,31-33H2,1-4H3,(H-,49,50,51,52,53);;;;;;
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| InChIKey |
SUTDRXZHNUGFSJ-UHFFFAOYSA-N
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| Pharmaceutical Properties | Molecule Weight |
1069.151 |
Polar area |
263.61 |
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Complexity |
2854.188739 |
xlogp Value |
3.0836 |
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Heavy Count |
70 |
Rot Bonds |
16 |
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Hbond acc |
15 |
Hbond Donor |
1 |
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Each Antibody-drug Conjugate Related to This Payload