Serotonin | SBID = 51 | Compound |
Structure
Molecular Properties
| Interactions: | 29 | ||
| PubChem TPSA/Å2: | 62.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 0.2 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 3.0 | ||
| Number of H-Bond Acceptors: | 2.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 140.4 | ||
| Sum Formula: | C10H12N2O | ||
| M / g/mol: | 176.219 | ||
| Complexity: | 174.0 | ||
| Number of Conformers: | 5.0 |
Identifiers
- Tags: neurotransmitter, aromatic, typical guest
- Name: Serotonin
- Preferred Abbreviation: Serotonin
- IUPAC Name: 3-(2-aminoethyl)-1H-indol-5-ol
- CAS: 50-67-9
- CID: 5202
- InChiKey: QZAYGJVTTNCVMB-UHFFFAOYSA-N
- InChi: InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
- CanoSmiles: C1=CC2=C(C=C1O)C(=CN2)CCN
- IsoSmiles: C1=CC2=C(C=C1O)C(=CN2)CCN
