General Information of This Payload
Payload ID
PAY0TMSTQ
Name
CN119630431A-ADC-63-PAYLOAD
Synonyms
CN119630431A-ADC-63-PAYLOAD
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Structure
Formula
C83H116N12O21
Isosmiles
CC1(NCC#CC2=CC=C(OC)C(N(CCC3=O)C(N3CNC([C@@H](NC(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)=O)CC(N)=O)=O)=O)=C2)CCN(CC1)C4CCN(CC4)C5=NC([C@@](CO)(OC6CC6)C7=CC=CC=C7)=C8C=C(C9=CN(C)C(C%10=C9C=CN%10)=O)C=CC8=N5
InChI
InChI=1S/C83H116N12O21/c1-82(23-30-92(31-24-82)64-19-27-93(28-20-64)80-89-69-16-13-62(68-58-91(2)79(101)76-66(68)18-26-85-76)56-67(69)77(90-80)83(59-96,116-65-14-15-65)63-10-6-5-7-11-63)87-25-8-9-61-12-17-72(104-4)71(55-61)94-29-21-75(99)95(81(94)102)60-86-78(100)70(57-73(84)97)88-74(98)22-32-105-35-36-107-39-40-109-43-44-111-47-48-113-51-52-115-54-53-114-50-49-112-46-45-110-42-41-108-38-37-106-34-33-103-3/h5-7,10-13,16-18,26,55-56,58,64-65,70,85,87,96H,14-15,19-25,27-54,57,59-60H2,1-4H3,(H2,84,97)(H,86,100)(H,88,98)/t70-,83-/m0/s1
InChIKey
BNSJBHFBUIQVJW-PYJJPPNPSA-N
Pharmaceutical Properties
Molecule Weight
1617.904
Polar area
373.44
Complexity
4049.873623
xlogp Value
4.1766
Heavy Count
116
Rot Bonds
54
Hbond acc
27
Hbond Donor
6
Each Antibody-drug Conjugate Related to This Payload