General Information of the Compound
| Compound ID |
CP0908090
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
SID85797706
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C31H37N3O6S
|
||||||||||||||||||
| Molecular Weight |
579.719
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc(S(=O)(=O)N(C)C[C@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N([C@H](C)CO)C[C@@H]2C)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C31H37N3O6S/c1-21-10-13-26(14-11-21)41(38,39)33(4)19-29-22(2)18-34(23(3)20-35)31(37)27-17-25(12-15-28(27)40-29)32-30(36)16-24-8-6-5-7-9-24/h5-15,17,22-23,29,35H,16,18-20H2,1-4H3,(H,32,36)/t22-,23+,29+/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
SOPJYAHWXXWBIB-QFWOEDSFSA-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