| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | No |
Popular Name: (3S)-3-methyl-N-phenyl-thiomorpholine-4-carboxamidine (3S)-3-methyl-N-phenyl-thiomorph…
None
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.21 | 7.62 | -29.9 | 3 | 3 | 1 | 41 | 236.364 | 3 | ↓ |
| Hi High (pH 8-9.5) | -2.11 | 8.45 | -28.45 | 3 | 3 | 1 | 41 | 236.364 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 9.21 | -5.24 | 2 | 3 | 0 | 42 | 235.356 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
