General Information of This Payload
Payload ID
PAY0JOGQR
Name
Conjugate No.168 Payload
Synonyms
Conjugate No.168 Payload
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Structure
Formula
C52H55N11O11
Isosmiles
CN1C(C(N(C=C2)C3=C2C=C(OC)C=C3)=O)=CC(C4=CC=C(NC(C5=NC(NC(CCCOC6=C(OC)C=C(C7=O)C(N[C@@H](OCC(N=N8)=CN8CCOCCC(O)=O)[C@]9([H])CC(CN97)=C)=C6)=O)=CN5C)=O)C=C4)=C1
InChI
InChI=1S/C52H55N11O11/c1-31-21-41-50(74-30-36-28-61(58-57-36)17-20-72-19-15-47(65)66)54-39-25-44(43(71-5)24-38(39)51(68)63(41)26-31)73-18-6-7-46(64)55-45-29-60(3)48(56-45)49(67)53-35-10-8-32(9-11-35)34-23-42(59(2)27-34)52(69)62-16-14-33-22-37(70-4)12-13-40(33)62/h8-14,16,22-25,27-29,41,50,54H,1,6-7,15,17-21,26,30H2,2-5H3,(H,53,67)(H,55,64)(H,65,66)/t41-,50-/m0/s1
InChIKey
CGKNDGVZOFPMKS-SWKRKFTISA-N
Pharmaceutical Properties
Molecule Weight
1010.078
Polar area
249.45
Complexity
3229.637944
xlogp Value
5.9579
Heavy Count
74
Rot Bonds
21
Hbond acc
18
Hbond Donor
4
Each Antibody-drug Conjugate Related to This Payload