| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 15 | No |
Popular Name: (3S)-1-[(3S)-3-(aminomethyl)tetrahydrothiophen-3-yl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[(3S)-3-(aminomethyl)tetr…
| 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) | 0.01 | 3.17 | -95.63 | 4 | 3 | 2 | 35 | 231.409 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.01 | -0.04 | -2.79 | 2 | 3 | 0 | 32 | 229.393 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.01 | 0.79 | -46.37 | 3 | 3 | 1 | 34 | 230.401 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
