General Information of This Payload
Payload ID
PAY0VAEJW
Name
D-D7 payload
Synonyms
D-D7
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Target DNA topoisomerase I (TOP1)
Structure
Formula
C29H28FN3O6
Isosmiles
CC1=C(C2=C3C=C1F)CC[C@H](NC(C([2H])(C4CC4)O)=O)C2=C(C(C5=CC([C@@]6(O)CC)=C7COC6=O)=N3)CN5C7=O
PubChem CID
170524191
InChI
InChI=1S/C29H28FN3O6/c1-3-29(38)17-8-21-24-15(10-33(21)27(36)16(17)11-39-28(29)37)23-19(32-26(35)25(34)13-4-5-13)7-6-14-12(2)18(30)9-20(31-24)22(14)23/h8-9,13,19,25,34,38H,3-7,10-11H2,1-2H3,(H,32,35)/t19-,25?,29-/m0/s1/i25D
InChIKey
ODYAHADGPIHDQN-YDWKWKBVSA-N
Pharmaceutical Properties
Molecule Weight
534.562102
Polar area
130.75
Complexity
1694.76663
xlogp Value
2.40152
Heavy Count
39
Rot Bonds
4
Hbond acc
8
Hbond Donor
3
Each Antibody-drug Conjugate Related to This Payload