General Information of This Linker
Linker ID
LIN0NGFXZ
Linker Name
Daratumumab-I-44-0.59 linker
Linker Type
Unclear
Antibody-Linker Relation
Unclear
Structure
Formula
C95H138FN17O31S2
Isosmiles
CC([C@H](NC([C@H](CC(C)C)NC([C@@H](NC(CNC([C@@H](NC([C@@H](N1)CC(NCC2=CC=C(OC(CCOCCOCCOCCOCCOCCOCCOCCOCCN)=O)C(F)=C2)=O)=O)CC(C)C)=O)=O)CCC(O)=O)=O)=O)C(N[C@H](C(N[C@@H](CSSC[C@H](NC([C@@H](NC(C)=O)CC(O)=O)=O)C(N[C@H](C(N[C@@H](CC3=CNC4=C3C=CC=C4)C1=O)=O)C)=O)C(N[C@H](C(O)=O)[C@H](O)C)=O)=O)CC5=CNC6=C5C=CC=C6)=O)C
InChI
InChI=1S/C95H138FN17O31S2/c1-53(2)40-68-85(124)101-50-78(117)104-67(19-21-79(118)119)86(125)107-69(41-54(3)4)91(130)112-82(55(5)6)94(133)109-71(44-61-49-99-66-17-13-11-15-63(61)66)88(127)111-75(93(132)113-83(57(8)114)95(134)135)52-146-145-51-74(110-90(129)73(46-80(120)121)103-58(9)115)92(131)102-56(7)84(123)105-70(43-60-48-98-65-16-12-10-14-62(60)65)87(126)108-72(89(128)106-68)45-77(116)100-47-59-18-20-76(64(96)42-59)144-81(122)22-24-136-26-28-138-30-32-140-34-36-142-38-39-143-37-35-141-33-31-139-29-27-137-25-23-97/h10-18,20,42,48-49,53-57,67-75,82-83,98-99,114H,19,21-41,43-47,50-52,97H2,1-9H3,(H,100,116)(H,101,124)(H,102,131)(H,103,115)(H,104,117)(H,105,123)(H,106,128)(H,107,125)(H,108,126)(H,109,133)(H,110,129)(H,111,127)(H,112,130)(H,113,132)(H,118,119)(H,120,121)(H,134,135)/t56-,57+,67-,68-,69-,70-,71-,72-,73-,74-,75-,82-,83-/m0/s1
InChIKey
QQGJCGKUMCIIQZ-FFGRQSJESA-N
Pharmaceutical Properties
Molecule Weight
2097.369
Polar area
697.27
Complexity
.
xlogp Value
-1.4113
Heavy Count
146
Rot Bonds
52
Hbond acc
31
Hbond Donor
21
Each Antibody-drug Conjugate Related to This Linker