General Information of the Compound
| Compound ID |
CP0270705
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(S)-3-ethoxy-2-(3-(3-mesitylureido)-2-naphthamido)propanoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H29N3O5
|
||||||||||||||||||
| Molecular Weight |
463.534
|
||||||||||||||||||
| Canonical SMILES |
CCOC[C@H](NC(=O)c1cc2ccccc2cc1NC(=O)Nc1c(C)cc(C)cc1C)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H29N3O5/c1-5-34-14-22(25(31)32)27-24(30)20-12-18-8-6-7-9-19(18)13-21(20)28-26(33)29-23-16(3)10-15(2)11-17(23)4/h6-13,22H,5,14H2,1-4H3,(H,27,30)(H,31,32)(H2,28,29,33)/t22-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
SAKQSQBEWSFYSX-QFIPXVFZSA-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