General Information of This Payload
Payload ID
PAY0PXIFR
Name
AU2023306656A1 ADC1 payload
Synonyms
AU2023306656A1 ADC1 payload
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Structure
Formula
C42H44N8O6
Isosmiles
CN1C=C(NC(CCCOC(C(OC)=C2)=CC(N=CC3([H])CCCCN34)=C2C4=O)=O)C=C1C(NC(C=C5)=CC=C5C6=CN(C)C(C(NC7=CC=C(N)C=C7)=O)=C6)=O
InChI
InChI=1S/C42H44N8O6/c1-48-24-27(19-35(48)40(52)47-30-15-11-28(43)12-16-30)26-9-13-29(14-10-26)46-41(53)36-20-31(25-49(36)2)45-39(51)8-6-18-56-38-22-34-33(21-37(38)55-3)42(54)50-17-5-4-7-32(50)23-44-34/h9-16,19-25,32H,4-8,17-18,43H2,1-3H3,(H,45,51)(H,46,53)(H,47,52)
InChIKey
RWJUIBSKNCGGPE-UHFFFAOYSA-N
Pharmaceutical Properties
Molecule Weight
756.864
Polar area
174.31
Complexity
2301.781725
xlogp Value
6.6343
Heavy Count
56
Rot Bonds
12
Hbond acc
10
Hbond Donor
4
Each Antibody-drug Conjugate Related to This Payload