phosphatidylserine
SMILES | CCCC(=O)O[C@@H](COP(=O)(OC[C@@H](C(=O)O)N)O)COC(=O)CC |
InChIKey | UNJJBGNPUUVVFQ-ZJUUUORDSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 3 |
Rotatable bonds | 13 |
Molecular weight (Da) | 385.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Endogenous |
Approved drug | Yes |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NK1 | NK1R | Guinea pig | Tachykinin | A | pKi | 7.3 | 7.3 | 7.3 | ChEMBL |
NK1 | NK1R | Human | Tachykinin | A | pKi | 8.8 | 8.8 | 8.8 | ChEMBL |
NK1 | NK1R | Human | Tachykinin | A | pKi | 8.55 | 9.66 | 10.38 | PDSP Ki database |
NK1 | NK1R | Human | Tachykinin | A | pKd | 8.6 | 8.6 | 8.6 | Guide to Pharmacology |
NK1 | NK1R | Human | Tachykinin | A | pKi | 8.5 | 9.4 | 10.3 | Guide to Pharmacology |
NK2 | NK2R | Human | Tachykinin | A | pKi | 6.89 | 6.89 | 6.89 | PDSP Ki database |
NK2 | NK2R | Human | Tachykinin | A | pKi | 6.99 | 6.99 | 6.99 | ChEMBL |
NK2 | NK2R | Human | Tachykinin | A | pKi | 5.9 | 6.4 | 6.9 | Guide to Pharmacology |
NK3 | NK3R | Human | Tachykinin | A | pKi | 5.89 | 5.89 | 5.89 | PDSP Ki database |
NK3 | NK3R | Human | Tachykinin | A | pKi | 5.0 | 5.5 | 6.0 | Guide to Pharmacology |
NK3 | NK3R | Mouse | Tachykinin | A | pKi | 5.3 | 5.3 | 5.3 | Guide to Pharmacology |
NK1 | NK1R | Guinea pig | Tachykinin | A | pKi | 9.62 | 9.93 | 10.23 | PDSP Ki database |
NK1 | NK1R | Rat | Tachykinin | A | pKi | 8.99 | 9.63 | 10.27 | PDSP Ki database |
NK1 | NK1R | Rat | Tachykinin | A | pKi | 8.96 | 8.96 | 8.96 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
NK2 | NK2R | Golden hamster | Tachykinin | A | pIC50 | 6.83 | 6.83 | 6.83 | ChEMBL |
NK2 | NK2R | Rat | Tachykinin | A | pEC50 | 6.78 | 7.52 | 9.0 | ChEMBL |
NK2 | NK2R | Rat | Tachykinin | A | pIC50 | 6.7 | 6.7 | 6.7 | ChEMBL |
NK1 | NK1R | Guinea pig | Tachykinin | A | pEC50 | 8.25 | 8.52 | 9.0 | ChEMBL |
NK1 | NK1R | Guinea pig | Tachykinin | A | pIC50 | 10.15 | 10.15 | 10.15 | ChEMBL |
NK1 | NK1R | Human | Tachykinin | A | pEC50 | 9.0 | 9.42 | 10.24 | ChEMBL |
NK1 | NK1R | Human | Tachykinin | A | pIC50 | 8.77 | 9.16 | 9.92 | ChEMBL |
ghrelin | GHSR | Human | Ghrelin | A | pEC50 | 7.18 | 7.18 | 7.18 | ChEMBL |
NK2 | NK2R | Human | Tachykinin | A | pIC50 | 6.61 | 6.61 | 6.61 | ChEMBL |
NK3 | NK3R | Human | Tachykinin | A | pEC50 | 6.1 | 6.1 | 6.1 | ChEMBL |
NK3 | NK3R | Human | Tachykinin | A | pIC50 | 6.9 | 6.9 | 6.9 | ChEMBL |
MRGPRX2 | MRGX2 | Human | A orphans | A | pEC50 | 5.97 | 5.97 | 5.97 | Guide to Pharmacology |
NK3 | NK3R | Rat | Tachykinin | A | pEC50 | 5.12 | 5.12 | 5.12 | ChEMBL |
NK3 | NK3R | Rat | Tachykinin | A | pIC50 | 6.89 | 6.89 | 6.89 | ChEMBL |
NK3 | NK3R | Guinea pig | Tachykinin | A | pIC50 | 6.14 | 6.14 | 6.14 | ChEMBL |
NK1 | NK1R | Rat | Tachykinin | A | pIC50 | 8.82 | 9.5 | 9.92 | ChEMBL |