Payload Information
General Information of This Payload
| Payload ID | PAY0DZJIC |
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|---|---|---|---|---|---|---|
| Name | T-14 |
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| Synonyms |
T-14
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| Structure |
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| Formula | C68H66N4O27S2 |
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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]5C(O)=O)C=C4)=O)O)([H])CC6=C(C2)C=CS6)=O)=C3C=C1OCC7=CC(O)=CC(COC8=C(OC)C=C(C9=O)C(N(C(O)[C@]%10([H])CC%11=C(C=CS%11)CN9%10)C(OCC%12=CC=C(O[C@H](O%13)[C@H](O)[C@@H](O)[C@H](O)[C@H]%13C(O)=O)C=C%12)=O)=C8)=C7 |
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| InChI |
InChI=1S/C68H66N4O27S2/c1-90-45-18-39-41(71(61(82)43-22-49-34(11-13-100-49)24-69(43)59(39)80)67(88)94-26-30-3-7-37(8-4-30)96-65-55(78)51(74)53(76)57(98-65)63(84)85)20-47(45)92-28-32-15-33(17-36(73)16-32)29-93-48-21-42-40(19-46(48)91-2)60(81)70-25-35-12-14-101-50(35)23-44(70)62(83)72(42)68(89)95-27-31-5-9-38(10-6-31)97-66-56(79)52(75)54(77)58(99-66)64(86)87/h3-21,43-44,51-58,61-62,65-66,73-79,82-83H,22-29H2,1-2H3,(H,84,85)(H,86,87)/t43-,44-,51-,52-,53-,54-,55+,56+,57-,58-,61?,62?,65+,66+/m0/s1
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| InChIKey |
RPIWZNPZBBVZOY-KUQYPWBDSA-N
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| Pharmaceutical Properties | Molecule Weight |
1435.411 |
Polar area |
430.21 |
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Complexity |
4028.49495 |
xlogp Value |
3.317 |
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Heavy Count |
101 |
Rot Bonds |
18 |
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Hbond acc |
27 |
Hbond Donor |
11 |
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Each Antibody-drug Conjugate Related to This Payload