General Information of This Payload
Payload ID
PAY0MEJSM
Name
CN110997009B ADC#42 Payload
Synonyms
CN110997009B ADC#42 Payload
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Target Microtubule (MT)
Structure
Formula
C39H66N8O6
Isosmiles
CC([C@H](NC)C(N[C@@H](C(C)C)C(N(C)[C@@H]([C@H](OC)CC(N1CCC[C@@H]1[C@H](OC)[C@H](C(N[C@H](CN=[N+]=[N-])CC2=CC=CC=C2)=O)C)=O)[C@H](CC)C)=O)=O)C
InChI
InChI=1S/C39H66N8O6/c1-12-26(6)35(46(9)39(51)34(25(4)5)44-38(50)33(41-8)24(2)3)31(52-10)22-32(48)47-20-16-19-30(47)36(53-11)27(7)37(49)43-29(23-42-45-40)21-28-17-14-13-15-18-28/h13-15,17-18,24-27,29-31,33-36,41H,12,16,19-23H2,1-11H3,(H,43,49)(H,44,50)/t26-,27+,29-,30+,31+,33-,34-,35+,36+/m0/s1
InChIKey
ZDQPADBTNPTFIW-QNJJATTBSA-N
Pharmaceutical Properties
Molecule Weight
743.007
Polar area
178.07
Complexity
1298.503054
xlogp Value
4.3293
Heavy Count
53
Rot Bonds
22
Hbond acc
8
Hbond Donor
3
Each Antibody-drug Conjugate Related to This Payload