Payload Information
General Information of This Payload
| Payload ID | PAY0UTIMK |
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|---|---|---|---|---|---|---|
| Name | LLAuristatin E derivate |
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| Synonyms |
LLAuristatin E derivate
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| Target | Microtubule (MT) | |||||
| Formula | C38H65N5O7 |
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| Isosmiles | CC([C@@H](NC([C@H](N)C(C)C)=O)C(N([C@H]([C@@H](CC)C)[C@@H](OC)CC(N(CCC1)[C@H]1[C@@H](OC)[C@H](C)C(N[C@H]([C@H](O)C2=CC=CC=C2)C)=O)=O)C)=O)C |
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| InChI |
InChI=1S/C38H65N5O7/c1-12-24(6)33(42(9)38(48)32(23(4)5)41-37(47)31(39)22(2)3)29(49-10)21-30(44)43-20-16-19-28(43)35(50-11)25(7)36(46)40-26(8)34(45)27-17-14-13-15-18-27/h13-15,17-18,22-26,28-29,31-35,45H,12,16,19-21,39H2,1-11H3,(H,40,46)(H,41,47)/t24-,25+,26+,28-,29+,31-,32-,33-,34+,35+/m1/s1
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| InChIKey |
JHSBLUJOWCZSKB-PAWPBOAHSA-N
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| Pharmaceutical Properties | Molecule Weight |
703.966 |
Polar area |
163.53 |
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Complexity |
1179.649982 |
xlogp Value |
3.2691 |
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Heavy Count |
50 |
Rot Bonds |
19 |
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Hbond acc |
8 |
Hbond Donor |
4 |
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Each Antibody-drug Conjugate Related to This Payload