Payload Information
General Information of This Payload
| Payload ID | PAY0EACBU |
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|---|---|---|---|---|---|---|
| Name | Conjugate No.169 Payload |
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| Synonyms |
Conjugate No.169 Payload
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| Structure |
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| Formula | C51H55N11O12S |
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| Isosmiles | CN1C(C(N(C=C2)C3=C2C=C(OC)C=C3)=O)=CC(C4=CC=C(NC(C5=NC(NC(CCCOC6=C(OC)C=C(C7=O)C(N[C@@H](OCC(N=N8)=CN8CCOCCS(=O)(O)=O)[C@@]9([H])N7CC(C9)=C)=C6)=O)=CN5C)=O)C=C4)=C1 |
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| InChI |
InChI=1S/C51H55N11O12S/c1-31-21-41-49(74-30-36-28-60(57-56-36)16-18-72-19-20-75(67,68)69)53-39-25-44(43(71-5)24-38(39)50(65)62(41)26-31)73-17-6-7-46(63)54-45-29-59(3)47(55-45)48(64)52-35-10-8-32(9-11-35)34-23-42(58(2)27-34)51(66)61-15-14-33-22-37(70-4)12-13-40(33)61/h8-15,22-25,27-29,41,49,53H,1,6-7,16-21,26,30H2,2-5H3,(H,52,64)(H,54,63)(H,67,68,69)/t41-,49-/m0/s1
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| InChIKey |
NBNPNIPZOSYRLW-ITQUSKEUSA-N
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| Pharmaceutical Properties | Molecule Weight |
1046.133 |
Polar area |
266.52 |
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Complexity |
3373.947997 |
xlogp Value |
5.371 |
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Heavy Count |
75 |
Rot Bonds |
21 |
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Hbond acc |
19 |
Hbond Donor |
4 |
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Each Antibody-drug Conjugate Related to This Payload