| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: (1S)-1-(3-methylbenzothiophen-2-yl)-N-(2-pyrrolidin-1-ylethyl)ethanamine (1S)-1-(3-methylbenzothiophen-2-…
| 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) | 4.07 | 9.06 | -35.65 | 2 | 2 | 1 | 16 | 289.468 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.07 | 6.6 | -4.06 | 1 | 2 | 0 | 15 | 288.46 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.07 | 10.26 | -116.02 | 3 | 2 | 2 | 21 | 290.476 | 5 | ↓ |
