General Information of This Payload
Payload ID
PAY0BHCGQ
Name
CN115364238B+Compound 4+payload
Synonyms
CN115364238B+Compound 4+payload
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Formula
C48H71N7O8S
Isosmiles
C[C@H]([C@@H](N(C)C(C(NC([C@H](N(C)C(OCC1=CC=C(N)C=C1)=O)C(C)C)=O)C(C)C)=O)C(CC(N2CCC[C@H]2[C@H](OC)[C@H](C(N[C@H](C3=SC=CN3)CC4=CC=CC=C4)=O)C)=O)=O)CC
InChI
InChI=1S/C48H71N7O8S/c1-11-31(6)42(53(8)47(60)40(29(2)3)52-45(59)41(30(4)5)54(9)48(61)63-28-34-19-21-35(49)22-20-34)38(56)27-39(57)55-24-15-18-37(55)43(62-10)32(7)44(58)51-36(46-50-23-25-64-46)26-33-16-13-12-14-17-33/h12-14,16-17,19-23,25,29-32,36-37,40-43,50,64H,11,15,18,24,26-28,49H2,1-10H3,(H,51,58)(H,52,59)/t31-,32+,36-,37-,40?,41+,42+,43+/m0/s1
InChIKey
DNUGDUSPACWIOM-CEUNOWTPSA-N
Pharmaceutical Properties
Molecule Weight
906.204
Polar area
192.71
Complexity
1904.788827
xlogp Value
4.8743
Heavy Count
64
Rot Bonds
22
Hbond acc
10
Hbond Donor
5
Each Antibody-drug Conjugate Related to This Payload