| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: (1R,2S)-1-(4-isopropylpiperazin-1-yl)-1-(3-methyl-2-thienyl)propan-2-amine (1R,2S)-1-(4-isopropylpiperazin-…
| 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) | 1.97 | 5.75 | -93.32 | 4 | 3 | 2 | 35 | 283.485 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.97 | 3.16 | -1.63 | 2 | 3 | 0 | 32 | 281.469 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 3.53 | -41.35 | 3 | 3 | 1 | 34 | 282.477 | 4 | ↓ |
