General Information of This Payload
Payload ID
PAY0JLLVQ
Name
CN113874046B-ADC-3-PAYLOAD
Synonyms
CN113874046B-ADC-3-PAYLOAD
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Structure
Formula
C48H70ClN5O15
Isosmiles
C/C(CC1=CC(N(C(C[C@H](OC([C@@H](N(C(CCC(N(CCOCCOCCC(O)=O)C2CCNCC2)=O)=O)C)C)=O)[C@]3(O[C@H]3[C@@H]4C)C)=O)C)=C(Cl)C(OC)=C1)=C\C=C\[C@@H](OC)[C@@]5(O)C[C@@H]4OC(N5)=O
InChI
InChI=1S/C48H70ClN5O15/c1-29-10-9-11-37(64-8)48(62)28-36(67-46(61)51-48)30(2)44-47(4,69-44)38(27-41(57)53(6)34-25-32(24-29)26-35(63-7)43(34)49)68-45(60)31(3)52(5)39(55)12-13-40(56)54(33-14-17-50-18-15-33)19-21-66-23-22-65-20-16-42(58)59/h9-11,25-26,30-31,33,36-38,44,50,62H,12-24,27-28H2,1-8H3,(H,51,61)(H,58,59)/t30-,31+,36+,37-,38+,44+,47-,48+/m1/s1
InChIKey
STSBXKGWALURNW-MZHLBYDMSA-N
Pharmaceutical Properties
Molecule Weight
992.561
Polar area
244.57
Complexity
1983.792847
xlogp Value
3.3832
Heavy Count
69
Rot Bonds
18
Hbond acc
15
Hbond Donor
4
Each Antibody-drug Conjugate Related to This Payload