indoramin
SMILES | O=C(c1ccccc1)NC1CCN(CC1)CCc1c[nH]c2c1cccc2 |
InChIKey | JXZZEXZZKAWDSP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 2 |
Rotatable bonds | 5 |
Molecular weight (Da) | 347.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 7.4 | 7.51 | 7.6 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 6.8 | 6.88 | 6.96 | ChEMBL |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 6.28 | 6.28 | 6.28 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 6.32 | 6.32 | 6.32 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 8.4 | 8.41 | 8.43 | ChEMBL |
α1B | ADA1B | Rat | Adrenoceptors | A | pKi | 6.65 | 6.65 | 6.65 | PDSP Ki database |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 8.07 | 8.07 | 8.07 | Drug Central |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 8.4 | 8.4 | 8.4 | Guide to Pharmacology |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 8.12 | 8.12 | 8.12 | Drug Central |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 6.8 | 7.1 | 7.4 | Guide to Pharmacology |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 8.16 | 8.16 | 8.16 | Drug Central |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 6.3 | 6.5 | 6.7 | Guide to Pharmacology |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 8.25 | 8.25 | 8.25 | Drug Central |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 5.65 | 5.65 | 5.65 | ChEMBL |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 8.2 | 8.2 | 8.2 | Drug Central |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 8.2 | 8.2 | 8.2 | Drug Central |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.11 | 8.11 | 8.11 | Drug Central |
5-HT2A | 5HT2A | Rat | 5-Hydroxytryptamine | A | pKi | 6.48 | 6.48 | 6.48 | PDSP Ki database |
α1A | ADA1A | Bovine | Adrenoceptors | A | pKi | 8.1 | 8.1 | 8.1 | Drug Central |
α1A | ADA1A | Bovine | Adrenoceptors | A | pKi | 7.92 | 7.92 | 7.92 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |