General Information of This Payload
Payload ID
PAY0RBKOC
Name
AU2020291014A1-Payload-35
Synonyms
AU2020291014A1-Payload-35
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Structure
Formula
C32H44N6O5S
Isosmiles
CCCN(CCCNC(OC(C)(C)C)=O)C(C(CC(N)=N1)=CC2=C1C=C(C=C2)C3=CC(S(=O)(N4CC(CN)C4)=O)=CC=C3)=O
InChI
InChI=1S/C32H44N6O5S/c1-5-13-37(14-7-12-35-31(40)43-32(2,3)4)30(39)26-15-25-11-10-24(17-28(25)36-29(34)18-26)23-8-6-9-27(16-23)44(41,42)38-20-22(19-33)21-38/h6,8-11,15-17,22H,5,7,12-14,18-21,33H2,1-4H3,(H2,34,36)(H,35,40)
InChIKey
AGTAMUSEEHZEPM-UHFFFAOYSA-N
Pharmaceutical Properties
Molecule Weight
624.808
Polar area
160.42
Complexity
1487.24951
xlogp Value
3.862
Heavy Count
44
Rot Bonds
11
Hbond acc
8
Hbond Donor
3
Each Antibody-drug Conjugate Related to This Payload
Full Information of The Activity Data of The ADC(s) Related to This Payload
AU2020291014A1 IC-23 [Investigative]
Revealed Based on the Cell Line Data
Click To Hide/Show 1 Activity Data Related to This Level
Experiment 1 Reporting the Activity Date of This ADC [1]
Efficacy Data Half Maximal Effective Concentration (EC50)
464 nM
Method Description
Mycloid TNFa Secretion
In Vitro Model Mycloid Mycloid cells Homo sapiens
References
Ref 1 Aminobenzazepine compounds, immunoconjugates, and uses thereof