RI01721601 | Difelikefalin,2TMS,isomer#15 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O)CC1 | TMS | 823.4848 | Semi standard non polar | 5454.382 |
RI01721600 | Difelikefalin,2TMS,isomer#14 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 823.4848 | Semi standard non polar | 5445.7803 |
RI01721599 | Difelikefalin,2TMS,isomer#13 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O)CC1 | TMS | 823.4848 | Semi standard non polar | 5671.1035 |
RI01721598 | Difelikefalin,2TMS,isomer#12 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)N([C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O)CC1)[Si](C)(C)C | TMS | 823.4848 | Semi standard non polar | 5329.605 |
RI01721597 | Difelikefalin,2TMS,isomer#11 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O)CC1 | TMS | 823.4848 | Semi standard non polar | 5533.032 |
RI01721596 | Difelikefalin,2TMS,isomer#10 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O)CC1 | TMS | 823.4848 | Semi standard non polar | 5387.9204 |
RI01721595 | Difelikefalin,2TMS,isomer#9 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C | TMS | 823.4848 | Semi standard non polar | 5380.3403 |
RI01721594 | Difelikefalin,2TMS,isomer#8 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O)CC1 | TMS | 823.4848 | Semi standard non polar | 5601.6997 |
RI01721593 | Difelikefalin,2TMS,isomer#7 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O)CC1 | TMS | 823.4848 | Semi standard non polar | 5636.3027 |
RI01721592 | Difelikefalin,2TMS,isomer#6 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N([C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)[Si](C)(C)C | TMS | 823.4848 | Semi standard non polar | 5210.0503 |
RI01721591 | Difelikefalin,2TMS,isomer#5 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1 | TMS | 823.4848 | Semi standard non polar | 5260.3496 |
RI01721590 | Difelikefalin,2TMS,isomer#4 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 823.4848 | Semi standard non polar | 5258.82 |
RI01721589 | Difelikefalin,2TMS,isomer#3 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O[Si](C)(C)C)CC1 | TMS | 823.4848 | Semi standard non polar | 5473.747 |
RI01721588 | Difelikefalin,2TMS,isomer#2 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1 | TMS | 823.4848 | Semi standard non polar | 5515.8105 |
RI01721587 | Difelikefalin,2TMS,isomer#1 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1 | TMS | 823.4848 | Semi standard non polar | 5441.322 |
RI01721586 | Difelikefalin,3TMS,isomer#53 | JsmolCC(C)C[C@H](C(=O)N([C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O)CC1)[Si](C)(C)C)N(C(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4721.7803 |
RI01721585 | Difelikefalin,3TMS,isomer#52 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N([C@H](CCCCN)C(=O)N1CCC(C(=O)O)(N([Si](C)(C)C)[Si](C)(C)C)CC1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4866.636 |
RI01721584 | Difelikefalin,3TMS,isomer#51 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(C(=O)O)(N([Si](C)(C)C)[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4897.7866 |
RI01721583 | Difelikefalin,3TMS,isomer#50 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N([C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O)CC1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4814.461 |
RI01721582 | Difelikefalin,3TMS,isomer#49 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4827.873 |
RI01721581 | Difelikefalin,3TMS,isomer#48 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(C(=O)O)(N([Si](C)(C)C)[Si](C)(C)C)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4882.3447 |
RI01721580 | Difelikefalin,3TMS,isomer#47 | JsmolCC(C)C[C@H](C(=O)N([C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O)CC1)[Si](C)(C)C)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4790.8823 |
RI01721579 | Difelikefalin,3TMS,isomer#46 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N([C@H](CCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O)CC1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4849.5723 |
RI01721578 | Difelikefalin,3TMS,isomer#45 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N[C@H](CCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O)CC1 | TMS | 895.5243 | Standard non polar | 4886.477 |
RI01721577 | Difelikefalin,3TMS,isomer#44 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N([C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O)CC1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4793.4863 |