(NE)-N-(2-prop-2-enylcyclopentylidene)hydroxylamine
Formula:C8H13NO
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-(2-prop-2-enylcyclopentylidene)hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-(2-prop-2-enylcyclopentylidene)hydroxylamine |
| MolecularFormula | C8H13NO |
| Smiles | C=CCC(CCC1)/C1=N/O |
| InChI | InChI=1S/C8H13NO/c1-2-4-7-5-3-6-8(7)9-10/h2,7,10H,1,3-6H2/t7-/m0/s1 |
| InChIK | SHMBUQUHJIWWCQ-ZETCQYMHSA-N |
| TotalMolweight | 139.197 |
| Molweight | 139.197 |
| MonoisotopicMass | 139.099714 |
| CLogP | 2.6156 |
| CLogS | -2.546 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 121.4 |
| Relative PSA | 0.20272 |
| PolarSurfaceArea | 32.59 |
| Druglikeness | -6.3452 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 10 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3Atoms | 6 |
| StereoCon | racemate |
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