Chemical Name - 5-BROMO VALERIC ACID
Mol Weight - 181.028
Smiles - OC(CCCCBr)=O
Mol Weight - 181.028
Smiles - OC(CCCCBr)=O
| Property Value | |
| Mol Name | 5-BROMO VALERIC ACID |
| Molweight | 181.028 |
| Monoisotopic Mass | 179.978591 |
| Clogp | 1.4244 |
| Clogs | -1.812 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 111.27 |
| Relative Psa | 0.23492 |
| Polar Surface Area | 37.3 |
| Druglikeness | -21.665 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.875 |
| Molecular Flexibility | 0.65597 |
| Molecular Complexity | 0.59725 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bonds | 4 |
| Sp3 Atoms | 5 |
| Acidic Oxygens | 1 |
| Smiles | OC(CCCCBr)=O |
| InChIKey | |
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