General Information of This Payload
Payload ID
PAY0FROFP
Name
CL202203715A1 P43
Synonyms
CL202203715A1 P43
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Structure
Formula
C38H61N5O8S2
Isosmiles
CCCCCCN(C(C[C@@H](C)CC)=O)[C@@H](C(C)C)C[C@@H](OC(C)=O)C1=NC(C(NS(C2=CC=C(O)C=C2)(=O)=O)=O)=CS1.CN3CCCC[C@@H]3C(NC)=O
InChI
InChI=1S/C30H45N3O7S2.C8H16N2O/c1-7-9-10-11-16-33(28(36)17-21(5)8-2)26(20(3)4)18-27(40-22(6)34)30-31-25(19-41-30)29(37)32-42(38,39)24-14-12-23(35)13-15-24;1-9-8(11)7-5-3-4-6-10(7)2/h12-15,19-21,26-27,35H,7-11,16-18H2,1-6H3,(H,32,37);7H,3-6H2,1-2H3,(H,9,11)/t21-,26+,27+;7-/m01/s1
InChIKey
ZMJKNYQCUGOJFV-MBDSSUBPSA-N
Pharmaceutical Properties
Molecule Weight
780.067
Polar area
175.31
Complexity
1497.588452
xlogp Value
6.0481
Heavy Count
53
Rot Bonds
18
Hbond acc
11
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
TRSQ-ZP3A-LP22 [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)
0.376 nM
Positive HER2 expression (HER2+++/++)
Method Description
The anti-proliferation test was carried out with SK-BR-3 human breast cancer cell line. Cells were grown in McCoy's 5a medium supplemented with 27% FBS,penicillin/streptomycin and L-glutamine.
In Vitro Model Breast adenocarcinoma SK-BR-3 cells CVCL_0033
CTRL-ZP3A-LP22 [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)
461.721 nM
Positive HER2 expression (HER2+++/++)
Method Description
The anti-proliferation test was carried out with SK-BR-3 human breast cancer cell line. Cells were grown in McCoy's 5a medium supplemented with 28% FBS,penicillin/streptomycin and L-glutamine.
In Vitro Model Breast adenocarcinoma SK-BR-3 cells CVCL_0033
References
Ref 1 Tubulysins and protein-tubulysin conjugates