General Information of This Payload
Payload ID
PAY0PHHQL
Name
RU20241285-23-payload
Synonyms
RU20241285-23-payload
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Target DNA topoisomerase I (TOP1)
Structure
Formula
C26H22F3N3O5
Isosmiles
CC[C@@](C(C=C1C2=NC(C=C(F)C(C)=C3CC[C@@H]4NC(C(F)F)=O)=C3C4=C2CN1C5=O)=C5CO6)(O)C6=O
PubChem CID
176763311
InChI
InChI=1S/C26H22F3N3O5/c1-3-26(36)14-6-18-21-12(8-32(18)24(34)13(14)9-37-25(26)35)20-16(31-23(33)22(28)29)5-4-11-10(2)15(27)7-17(30-21)19(11)20/h6-7,16,22,36H,3-5,8-9H2,1-2H3,(H,31,33)/t16-,26-/m0/s1
InChIKey
UNWXZOBEHFAQGJ-QMTYFTJSSA-N
Pharmaceutical Properties
Molecule Weight
513.472
Polar area
110.52
Complexity
1566.537054
xlogp Value
2.89572
Heavy Count
37
Rot Bonds
3
Hbond acc
7
Hbond Donor
2
Each Antibody-drug Conjugate Related to This Payload