| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 21 | Yes |
Popular Name: (2S)-3-methyl-N-[(1R)-1-(5-methyl-2-furyl)ethyl]-2-(4-methylpiperazin-1-yl)butan-1-amine (2S)-3-methyl-N-[(1R)-1-(5-methy…
| 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) | 2.57 | 7.4 | -91.81 | 3 | 4 | 2 | 37 | 295.471 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.57 | 7.45 | -109.91 | 3 | 4 | 2 | 37 | 295.471 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.57 | 5.03 | -36.43 | 2 | 4 | 1 | 36 | 294.463 | 6 | ↓ |
