Payload Information
General Information of This Payload
| Payload ID | PAY0NYPXQ |
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|---|---|---|---|---|---|---|
| Name | T-13 |
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| Synonyms |
T-13
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| Structure |
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| Formula | C73H79N5O24S |
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| Isosmiles | COC1=CC(C(N2[C@@](C(N3C(OCC4=CC=C(O[C@H](O5)[C@H](O)[C@@H](O)[C@H](O)[C@H]5CO)C=C4)=O)O)([H])CC6=C(C2)C=CS6)=O)=C3C=C1OCC7=CC(CN(C)C)=CC(COC8=C(OC)C=C(C9=O)C(N(C(O)[C@]%10([H])CC%11=C(C=CC=C%11)CN9%10)C(OCC%12=CC=C(O[C@H](O%13)[C@H](O)[C@@H](O)[C@@H](O)[C@H]%13CO)C=C%12)=O)=C8)=C7 |
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| InChI |
InChI=1S/C73H79N5O24S/c1-74(2)28-39-19-40(35-95-55-25-49-47(23-53(55)93-3)66(87)75-29-43-8-6-5-7-42(43)22-51(75)68(89)77(49)72(91)97-33-37-9-13-45(14-10-37)99-70-64(85)62(83)60(81)57(31-79)101-70)21-41(20-39)36-96-56-26-50-48(24-54(56)94-4)67(88)76-30-44-17-18-103-59(44)27-52(76)69(90)78(50)73(92)98-34-38-11-15-46(16-12-38)100-71-65(86)63(84)61(82)58(32-80)102-71/h5-21,23-26,51-52,57-58,60-65,68-71,79-86,89-90H,22,27-36H2,1-4H3/t51-,52-,57+,58+,60-,61+,62-,63-,64+,65+,68?,69?,70+,71+/m0/s1
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| InChIKey |
XYZZCAMHSBKHFR-JVPONLRNSA-N
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| Pharmaceutical Properties | Molecule Weight |
1442.513 |
Polar area |
379.08 |
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Complexity |
4235.482311 |
xlogp Value |
3.4269 |
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Heavy Count |
103 |
Rot Bonds |
20 |
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Hbond acc |
26 |
Hbond Donor |
10 |
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Each Antibody-drug Conjugate Related to This Payload