cimetidine
- CAS:
- Other names:
- SMILES: CN=C(NCCSCc1nc[nH]c1C)NC#N
Properties
MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
---|---|---|---|---|---|---|---|---|
252.34 | 6 | 3 | 1.38 | 114.19 | 7 | 85 | 0.50 | C10H16N6S |
Availability
Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
---|---|---|---|---|---|---|
SF_C32 | None | Jan. 1, 2023 |
Bar codes
Plate barcode | Sample barcode |
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PAINS
Identified PAINS |
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Not checked |
Supramolecules
Name | log K | SD | pH | T(°C) | Method | Ref |
---|---|---|---|---|---|---|
[b-Cyclodextrin](1).[cimetidine] | 2.63 | 6.8 | 25.0 | HPLC-method | Alamdar Ashnagar 2005 | |
[b-CDNSC](1).[cimetidine] | 2.67 | 6.8 | 25.0 | HPLC-method | Alamdar Ashnagar 2005 | |