Payload Information
General Information of This Payload
| Payload ID | PAY0TEYSL |
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|---|---|---|---|---|---|---|
| Name | T-9 |
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| Synonyms |
T-9
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| Structure |
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| Formula | C71H77N5O24S2 |
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| Isosmiles | COC1=CC(C2=O)=C(N(C(O)[C@]3([H])CC4=C(C=CS4)CN32)C(OCC5=CC=C(O[C@H]6[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O6)C=C5)=O)C=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)CN%109)C(OCC%12=CC=C(O[C@H]%13[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O%13)C=C%12)=O)=C8)=C7 |
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| InChI |
InChI=1S/C71H77N5O24S2/c1-72(2)26-37-17-38(33-93-52-22-46-44(20-50(52)91-3)64(85)73-27-40-13-15-101-56(40)24-48(73)66(87)75(46)70(89)95-31-35-5-9-42(10-6-35)97-68-62(83)60(81)58(79)54(29-77)99-68)19-39(18-37)34-94-53-23-47-45(21-51(53)92-4)65(86)74-28-41-14-16-102-57(41)25-49(74)67(88)76(47)71(90)96-32-36-7-11-43(12-8-36)98-69-63(84)61(82)59(80)55(30-78)100-69/h5-23,48-49,54-55,58-63,66-69,77-84,87-88H,24-34H2,1-4H3/t48-,49-,54+,55+,58-,59-,60-,61-,62+,63+,66?,67?,68+,69+/m0/s1
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| InChIKey |
AFXSLYLJAGVXON-KZHGHBAOSA-N
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| Pharmaceutical Properties | Molecule Weight |
1448.542 |
Polar area |
379.08 |
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Complexity |
3926.069872 |
xlogp Value |
3.4884 |
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Heavy Count |
102 |
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