General Information of This Payload
Payload ID
PAY0JLTOK
Name
TWI857167B-IC-116-PAYLOAD
Synonyms
TWI857167B-IC-116-PAYLOAD
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Structure
Formula
C21H31N5O2S
Isosmiles
CCCN(OCC)C(C(CC(N)=N1)=CC2=C1C=C(S2)CN3C(CC4)CN[C@H]4C3)=O
InChI
InChI=1S/C21H31N5O2S/c1-3-7-26(28-4-2)21(27)14-8-19-18(24-20(22)9-14)10-17(29-19)13-25-12-15-5-6-16(25)11-23-15/h8,10,15-16,23H,3-7,9,11-13H2,1-2H3,(H2,22,24)/t15-,16?/m1/s1
InChIKey
BDYAVXAQFTWDMH-AAFJCEBUSA-N
Pharmaceutical Properties
Molecule Weight
417.579
Polar area
83.19
Complexity
768.96036
xlogp Value
2.6502
Heavy Count
29
Rot Bonds
7
Hbond acc
7
Hbond Donor
2
Each Antibody-drug Conjugate Related to This Payload