General Information of the Compound
| Compound ID |
CP0417803
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(4aS,5R,5aR)-5-(methoxymethyl)-3-(1H-tetrazol-5-yl)-4,4a,5,5a-tetrahydro-1H-cyclopropa[4,5]cyclopenta[1,2-c]pyrazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C10H12N6O
|
||||||||||||||||||
| Molecular Weight |
232.247
|
||||||||||||||||||
| Canonical SMILES |
COC[C@@H]1[C@H]2Cc3c([nH]nc3-c3nnn[nH]3)[C@@H]12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C10H12N6O/c1-17-3-6-4-2-5-8(7(4)6)11-12-9(5)10-13-15-16-14-10/h4,6-7H,2-3H2,1H3,(H,11,12)(H,13,14,15,16)/t4-,6-,7-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
SNHAYNGAPALUSS-QPPQHZFASA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound