| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | Yes |
Popular Name: (1S)-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(3-methylbenzothiophen-2-yl)ethanamine (1S)-N-[[(2S)-1-ethylpyrrolidin-…
| 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) | 4.43 | 9.96 | -32.89 | 2 | 2 | 1 | 16 | 303.495 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.43 | 8.17 | -4.14 | 1 | 2 | 0 | 15 | 302.487 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.43 | 9.32 | -36.1 | 2 | 2 | 1 | 20 | 303.495 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.43 | 11.11 | -112.75 | 3 | 2 | 2 | 21 | 304.503 | 5 | ↓ |
