3-chloro-N'-sulfamoylpropanimidamide
Formula:C3H8N3O2ClS
Mutagenic:low
Tumorigenic:high
Reproductive Effective:high
3-chloro-N'-sulfamoylpropanimidamide is a drug-like molecule.
| MolName | 3-chloro-N'-sulfamoylpropanimidamide |
| MolecularFormula | C3H8N3O2ClS |
| Smiles | N/C(/CCCl)=N\S(N)(=O)=O |
| InChI | InChI=1S/C3H8ClN3O2S/c4-2-1-3(5)7-10(6,8)9/h1-2H2,(H2,5,7)(H2,6,8,9) |
| InChIK | QZFCNUHDVLMXDA-UHFFFAOYSA-N |
| TotalMolweight | 185.635 |
| Molweight | 185.635 |
| MonoisotopicMass | 185.002574 |
| CLogP | -0.6579 |
| CLogS | -1.845 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 125.03 |
| Relative PSA | 0.5649 |
| PolarSurfaceArea | 106.92 |
| Druglikeness | -2.1425 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 10 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Sp3Atoms | 3 |
| Symmetricatoms | 1 |
| Amides | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - 3-chloro-N'-sulfamoylpropanimidamide | 2 - 3-chloro-N'-sulfamoylpropanimidamide
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