(3Z)-3-(carbamoylhydrazinylidene)cyclohexane-1-carboxylic acid
Formula:C8H13N3O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3Z)-3-(carbamoylhydrazinylidene)cyclohexane-1-carboxylic acid is a drug-like molecule.
| MolName | (3Z)-3-(carbamoylhydrazinylidene)cyclohexane-1-carboxylic acid |
| MolecularFormula | C8H13N3O3 |
| Smiles | NC(N/N=C(/CCC1)\CC1C(O)=O)=O |
| InChI | InChI=1S/C8H13N3O3/c9-8(14)11-10-6-3-1-2-5(4-6)7(12)13/h5H,1-4H2,(H,12,13)(H3,9,11,14)/t5-/m0/s1 |
| InChIK | WDORXFXRTKEOJF-YFKPBYRVSA-N |
| TotalMolweight | 199.209 |
| Molweight | 199.209 |
| MonoisotopicMass | 199.095692 |
| CLogP | -0.121 |
| CLogS | -2.311 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 152.34 |
| Relative PSA | 0.50821 |
| PolarSurfaceArea | 104.78 |
| Druglikeness | -0.58516 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3Atoms | 6 |
| Amides | 1 |
| AcidicOxygens | 1 |
| StereoCon | racemate |
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