General Information of This Linker
Linker ID
LIN0UHBKS
Linker Name
CN110997010A ADC-12 linker
Linker Type
Uncleavable linker
Antibody-Linker Relation
Uncleavable
Structure
Formula
C137H208N24O43S2
Isosmiles
CC(C)[C@H](NC(CCCCCN1C(C=CC1=O)=O)=O)C(N[C@H](C(O)NC2=CC=C(COC(NC(CSC(CC3=O)C(N3CC4CCC(C(NCC(N=N5)=CC5CCOCCOCCOCCOCCOCCOCCOCCOCCNC(COCC(N[C@H](CCCCN)C(NC6=CC=C(C=C6)CO)=O)=O)=O)=O)=CC4)=O)C(NC(C(O)=O)CSC(C7=O)CC(N7CC8CCC(C(NCC(N=N9)=CC9CCOCCOCCOCCOCCOCCOCCOCCOCCNC(COCC(N[C@H](CCCCN)C(NC%10=CC=C(C=C%10)CO)=O)=O)=O)=O)=CC8)=O)=O)=O)C=C2)CCCNC(N)=O)=O
InChI
InChI=1S/C137H208N24O43S2/c1-94(2)125(154-116(164)14-4-3-9-44-159-121(169)35-36-122(159)170)132(179)151-111(13-10-41-143-136(140)184)130(177)148-104-33-23-99(24-34-104)87-204-137(185)153-112(92-205-114-79-123(171)160(133(114)180)83-95-15-25-100(26-16-95)126(173)144-81-107-77-105(155-157-107)37-45-186-49-53-190-57-61-194-65-69-198-73-75-200-71-67-196-63-59-192-55-51-188-47-42-141-117(165)88-202-90-119(167)149-109(11-5-7-39-138)128(175)146-102-29-19-97(85-162)20-30-102)131(178)152-113(135(182)183)93-206-115-80-124(172)161(134(115)181)84-96-17-27-101(28-18-96)127(174)145-82-108-78-106(156-158-108)38-46-187-50-54-191-58-62-195-66-70-199-74-76-201-72-68-197-64-60-193-56-52-189-48-43-142-118(166)89-203-91-120(168)150-110(12-6-8-40-139)129(176)147-103-31-21-98(86-163)22-32-103/h19-25,27,29-36,77-78,94-96,105-106,109-115,125,130,148,162-163,177H,3-18,26,28,37-76,79-93,138-139H2,1-2H3,(H,141,165)(H,142,166)(H,144,173)(H,145,174)(H,146,175)(H,147,176)(H,149,167)(H,150,168)(H,151,179)(H,152,178)(H,153,185)(H,154,164)(H,182,183)(H3,140,143,184)/t95?,96?,105?,106?,109-,110-,111+,112?,113?,114?,115?,125+,130?/m1/s1
InChIKey
RCASRQGWHKIVHR-NTIPAYSASA-N
Pharmaceutical Properties
Molecule Weight
2943.43
Polar area
903.33
Complexity
.
xlogp Value
1.785
Heavy Count
206
Rot Bonds
117
Hbond acc
51
Hbond Donor
21
Each Antibody-drug Conjugate Related to This Linker