| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | No |
Popular Name: (3R)-3-(aminomethyl)-N-ethyl-1,1-dioxo-N-(2-thienylmethyl)thiolan-3-amine (3R)-3-(aminomethyl)-N-ethyl-1,1…
| 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) | 0.41 | 0.36 | -68.64 | 3 | 4 | 1 | 65 | 289.446 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.41 | 0.6 | -10.43 | 2 | 4 | 0 | 63 | 288.438 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
