Structure Info
- Chemspace ID
- CSSS00010360424 (In-Stock Screening Compounds)
- CAS
- 1543281-62-4, 1049790-05-7
- MFCD
- MFCD22105819
- IUPAC Name
- 7-chloroisoquinoline-4-carboxylic acid
- Mol formula
- C10H6ClNO2
- Mol weight
- 208 Da
- Catalog Number(s)
- BB4LS-EN300-269642, BBV-43554793, BL53513, CSC010360424, EN300-269642, FCH1598403, Y3186499, Z1416199308
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.32
- Heavy atoms count
- 14
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0
- Polar surface area (Å)
- 50
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00010360424
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