| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 19 | Yes |
Popular Name: N-allyl-N-[2-[4-[(1S)-1-methylpropyl]piperazin-1-yl]ethyl]prop-2-en-1-amine N-allyl-N-[2-[4-[(1S)-1-methylpr…
| 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) | 2.76 | 8.2 | -83.19 | 2 | 3 | 2 | 12 | 267.461 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 4.44 | -0.85 | 0 | 3 | 0 | 10 | 265.445 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 6.34 | -34.41 | 1 | 3 | 1 | 11 | 266.453 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.76 | 5.98 | -30.22 | 1 | 3 | 1 | 11 | 266.453 | 9 | ↓ |
