[(Z)-3-carbamimidoylsulfanylprop-2-enyl] carbamimidothioate
Formula:C5H10N4S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-3-carbamimidoylsulfanylprop-2-enyl] carbamimidothioate is a drug-like molecule.
| MolName | [(Z)-3-carbamimidoylsulfanylprop-2-enyl] carbamimidothioate |
| MolecularFormula | C5H10N4S2 |
| Smiles | NC(SC/C=C\SC(N)=N)=N |
| InChI | InChI=1S/C5H10N4S2/c6-4(7)10-2-1-3-11-5(8)9/h1-2H,3H2,(H3,6,7)(H3,8,9) |
| InChIK | AOUQQMCMGPCJIM-UHFFFAOYSA-N |
| TotalMolweight | 190.294 |
| Molweight | 190.294 |
| MonoisotopicMass | 190.034686 |
| CLogP | -0.7907 |
| CLogS | -0.742 |
| H Acceptors | 4 |
| H Donors | 4 |
| TotalSurfaceArea | 146.4 |
| Relative PSA | 0.66066 |
| PolarSurfaceArea | 150.34 |
| Druglikeness | -0.30662 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.81818 |
| Fragments | 1 |
| Non HAtoms | 11 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Sp3Atoms | 3 |
| BasicNitrogens | 2 |
| StereoCon |
Click to Load Molecule:
1 - [(Z)-3-carbamimidoylsulfanylprop-2-enyl] carbamimidothioate | 2 - [(Z)-3-carbamimidoylsulfanylprop-2-enyl] carbamimidothioate
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off