| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2010 | 19 | Yes |
Popular Name: (2S)-2-[4-(cyclopropylmethyl)piperazin-1-yl]-2-(3-methyl-2-thienyl)ethanamine (2S)-2-[4-(cyclopropylmethyl)pip…
| 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) | 1.77 | 5.65 | -98.62 | 4 | 3 | 2 | 35 | 281.469 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 3.38 | -43.78 | 3 | 3 | 1 | 34 | 280.461 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 3.11 | -2.1 | 2 | 3 | 0 | 32 | 279.453 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 5.36 | -33 | 3 | 3 | 1 | 34 | 280.461 | 5 | ↓ |
