| Collection |
D4 : TTD |
| Chemical Name |
BMS-269223 ( From PubChem : C H E M B L 5 5 1 9 9 1 ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Not | Not | Not | Not | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 436.507 g/mol |
2 |
9 |
2.92298 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 3 H 2 8 N 6 O 3 / c 1 - 1 6 - 1 2 - 1 7 - 1 3 - 1 8 ( 7 - 8 - 2 0 ( 1 7 ) 3 2 - 1 6 ) 2 6 - 2 3 ( 2 5 - 1 5 - 2 4 ) 2 7 - 1 9 - 6 - 2 - 3 - 1 1 - 2 9 ( 2 2 ( 1 9 ) 3 1 ) 1 4 - 2 1 ( 3 0 ) 2 8 - 9 - 4 - 5 - 1 0 - 2 8 / h 7 - 8 , 1 2 - 1 3 , 1 9 H , 2 - 6 , 9 - 1 1 , 1 4 H 2 , 1 H 3 , ( H 2 , 2 5 , 2 6 , 2 7 ) / t 1 9 - / m 0 / s 1 |
| InChIKey |
B Q U X A J W D R C S K F N - I B G Z P J M E S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | F10 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
