General Information of the Compound
| Compound ID |
CP0416659
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-Amino-2-{2-benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-hexanoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C32H40N3O7P
|
||||||||||||||||||
| Molecular Weight |
609.66
|
||||||||||||||||||
| Canonical SMILES |
NCCCCC(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C32H40N3O7P/c33-19-11-10-18-28(31(37)38)34-30(36)27(20-24-12-4-1-5-13-24)23-43(40,41)29(21-25-14-6-2-7-15-25)35-32(39)42-22-26-16-8-3-9-17-26/h1-9,12-17,27-29H,10-11,18-23,33H2,(H,34,36)(H,35,39)(H,37,38)(H,40,41)/t27?,28?,29-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
CPGHOZLHXUIXPD-BVDFDZHASA-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