| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | No |
Popular Name: (3S)-3-(aminomethyl)-N-ethyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]tetrahydrothiophen-3-amine (3S)-3-(aminomethyl)-N-ethyl-N-[…
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) | 0.61 | 4.16 | -118.01 | 4 | 3 | 2 | 41 | 246.42 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | 2.29 | -3.36 | 2 | 3 | 0 | 38 | 244.404 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 4.45 | -30.04 | 3 | 3 | 1 | 40 | 245.412 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 2.66 | -42.75 | 3 | 3 | 1 | 40 | 245.412 | 5 | ↓ |
