Payload Information
General Information of This Payload
| Payload ID | PAY0RIPFE |
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|---|---|---|---|---|---|---|
| Name | T-3 |
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| Synonyms |
T-3
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| Structure |
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| Formula | C72H79N5O24S2 |
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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)(C)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=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]%13CO)C=C%12)=O)=C8)=C7 |
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| InChI |
InChI=1S/C72H79N5O24S2/c1-72-26-57-42(15-17-103-57)29-75(72)65(87)46-22-51(93-5)53(24-48(46)77(69(72)89)71(91)97-33-37-8-12-44(13-9-37)99-68-63(85)61(83)59(81)55(31-79)101-68)95-35-40-19-38(27-73(2)3)18-39(20-40)34-94-52-23-47-45(21-50(52)92-4)64(86)74-28-41-14-16-102-56(41)25-49(74)66(88)76(47)70(90)96-32-36-6-10-43(11-7-36)98-67-62(84)60(82)58(80)54(30-78)100-67/h6-24,49,54-55,58-63,66-69,78-85,88-89H,25-35H2,1-5H3/t49-,54+,55+,58-,59-,60-,61-,62+,63+,66?,67+,68+,69?,72-/m0/s1
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| InChIKey |
IZFQVCYUDJFDFM-MDYSSMDCSA-N
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| Pharmaceutical Properties | Molecule Weight |
1462.569 |
Polar area |
379.08 |
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Complexity |
3926.069872 |
xlogp Value |
3.8785 |
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Heavy Count |
103 |
Rot Bonds |
20 |
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Hbond acc |
27 |
Hbond Donor |
10 |
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Each Antibody-drug Conjugate Related to This Payload