General Information of This Payload
Payload ID
PAY0NDVCD
Name
A-III-22 Payload
Synonyms
A-III-22 Payload
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Structure
Formula
C64H98N8O16
Isosmiles
C[C@@H](NC([C@@H]([C@H]([C@H]1N(C(C[C@@H](OC)[C@@H](N(C)C([C@@H](NC([C@@H](N(C)C(OC(C)C2=CC3=CC=C(NC(C(NC(C(NC(CCOCCO)=O)C(C)C)=O)C)=O)C=C3OC2=O)=O)C(C)C)=O)C(C)C)=O)[C@H](CC)C)=O)CCC1)OC)C)=O)[C@@H](O)C4=CC=CC=C4
InChI
InChI=1S/C64H98N8O16/c1-17-38(8)55(49(84-15)34-51(75)72-28-21-24-47(72)57(85-16)39(9)58(77)65-40(10)56(76)43-22-19-18-20-23-43)70(13)62(81)53(36(4)5)69-61(80)54(37(6)7)71(14)64(83)87-42(12)46-32-44-25-26-45(33-48(44)88-63(46)82)67-59(78)41(11)66-60(79)52(35(2)3)68-50(74)27-30-86-31-29-73/h18-20,22-23,25-26,32-33,35-42,47,49,52-57,73,76H,17,21,24,27-31,34H2,1-16H3,(H,65,77)(H,66,79)(H,67,78)(H,68,74)(H,69,80)/t38-,39+,40+,41?,42?,47-,49+,52?,53-,54-,55-,56+,57+/m0/s1
InChIKey
IVWMIZXFMMLLAW-NWBHGYRLSA-N
Pharmaceutical Properties
Molecule Weight
1235.528
Polar area
314.02
Complexity
2772.655413
xlogp Value
5.2294
Heavy Count
88
Rot Bonds
33
Hbond acc
16
Hbond Donor
7
Each Antibody-drug Conjugate Related to This Payload