| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 17 | Yes |
Popular Name: (2S)-N-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-phenyl-ethanamine (2S)-N-methyl-2-[(5-methyl-1,3,4…
| 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) | 2.33 | 6.27 | -36.85 | 2 | 3 | 1 | 42 | 266.415 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 4.96 | -6.62 | 1 | 3 | 0 | 38 | 265.407 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
