General Information of This Payload
Payload ID
PAY0IRCAQ
Name
INX-SM-3 payload
Synonyms
INX-SM-3
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Structure
Formula
C34H41NO6
Isosmiles
C[C@]12C[C@H](O)[C@@]([C@]3(C=CC4=O)C)([H])[C@](CCC3=C4)([H])[C@]1([H])C[C@@H]5[C@]2(O[C@H](C6=CC=C(C=C6)CC7(C8)CC8(N)C7)O5)C(CO)=O
PubChem CID
164574255
InChI
InChI=1S/C34H41NO6/c1-30-10-9-22(37)11-21(30)7-8-23-24-12-27-34(26(39)15-36,31(24,2)14-25(38)28(23)30)41-29(40-27)20-5-3-19(4-6-20)13-32-16-33(35,17-32)18-32/h3-6,9-11,23-25,27-29,36,38H,7-8,12-18,35H2,1-2H3/t23-,24-,25-,27+,28+,29+,30-,31-,32?,33?,34+/m0/s1
InChIKey
CDJPBPKXKGBUJI-OPLRTLBKSA-N
Pharmaceutical Properties
Molecule Weight
559.703
Polar area
119.08
Complexity
1495.175038
xlogp Value
3.7133
Heavy Count
41
Rot Bonds
5
Hbond acc
7
Hbond Donor
3
Each Antibody-drug Conjugate Related to This Payload