General Information of This Payload
Payload ID
PAY0DHNOQ
Name
TWI857167B-IC-56-PAYLOAD
Synonyms
TWI857167B-IC-56-PAYLOAD
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Structure
Formula
C29H48N6O6S2
Isosmiles
CCCN(CCCNC(CC(C)(C)C)=O)C(C(CC(N)=N1)=CC2=C1C=C(S2)CCCCCNC([C@@H](N)CS(=O)(O)=O)=O)=O
InChI
InChI=1S/C29H48N6O6S2/c1-5-13-35(14-9-12-32-26(36)18-29(2,3)4)28(38)20-15-24-23(34-25(31)16-20)17-21(42-24)10-7-6-8-11-33-27(37)22(30)19-43(39,40)41/h15,17,22H,5-14,16,18-19,30H2,1-4H3,(H2,31,34)(H,32,36)(H,33,37)(H,39,40,41)/t22-/m0/s1
InChIKey
UQPWFTDBQUDUNH-QFIPXVFZSA-N
Pharmaceutical Properties
Molecule Weight
640.873
Polar area
197.28
Complexity
1223.214812
xlogp Value
2.7491
Heavy Count
43
Rot Bonds
17
Hbond acc
9
Hbond Donor
5
Each Antibody-drug Conjugate Related to This Payload