Payload Information
General Information of This Payload
| Payload ID | PAY0BBLOJ |
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|---|---|---|---|---|---|---|
| Name | P9 |
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| Synonyms |
P9
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| Structure |
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| Formula | C75H99FN18O16 |
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| Isosmiles | CC1=CC(CCC[C@H](NC([C@@H](NC([C@H](CC(C)=O)NC([C@@H](NC([C@@H](NC([C@](CC2=CC=CC=C2F)(NC(/C([C@H](O)C)=N/C(CNC([C@@H](NC(C(C)(C)C(NCCC3=CN=CN3)=O)=O)CC4=NNN=N4)=O)=O)=O)C)=O)[C@H](O)C)=O)CO)=O)=O)CC5=CC=C(C6=CC=C(OCCCCN)C=C6CC)C=C5)=O)C(N)=O)=CC=C1 |
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| InChI |
InChI=1S/C75H99FN18O16/c1-9-48-35-52(110-31-13-12-29-77)26-27-53(48)49-24-22-47(23-25-49)34-57(67(103)83-55(64(78)100)21-15-18-46-17-14-16-42(2)32-46)85-66(102)56(33-43(3)96)84-68(104)59(40-95)86-69(105)62(44(4)97)89-73(109)75(8,37-50-19-10-11-20-54(50)76)90-70(106)63(45(5)98)88-61(99)39-81-65(101)58(36-60-91-93-94-92-60)87-72(108)74(6,7)71(107)80-30-28-51-38-79-41-82-51/h10-11,14,16-17,19-20,22-27,32,35,38,41,44-45,55-59,62,95,97-98H,9,12-13,15,18,21,28-31,33-34,36-37,39-40,77H2,1-8H3,(H2,78,100)(H,79,82)(H,80,107)(H,81,101)(H,83,103)(H,84,104)(H,85,102)(H,86,105)(H,87,108)(H,89,109)(H,90,106)(H,91,92,93,94)/t44-,45-,55+,56+,57+,58+,59+,62+,75+/m1/s1
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| InChIKey |
RFFKGFBYDSSQBW-CNULTYRHSA-N
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| Pharmaceutical Properties | Molecule Weight |
1527.725 |
Polar area |
530.57 |
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Complexity |
4055.172684 |
xlogp Value |
-0.76088 |
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Heavy Count |
110 |
Rot Bonds |
44 |
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Hbond acc |
21 |
Hbond Donor |
16 |
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Each Antibody-drug Conjugate Related to This Payload