| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2010 | 17 | Yes |
Popular Name: (3S,4S)-N-methyl-3-(4-propylpiperazin-1-yl)tetrahydropyran-4-amine (3S,4S)-N-methyl-3-(4-propylpipe…
| 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) | 0.99 | 4.13 | -93.01 | 3 | 4 | 2 | 34 | 243.395 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 1 | -1.42 | 1 | 4 | 0 | 28 | 241.379 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 1.86 | -36.1 | 2 | 4 | 1 | 32 | 242.387 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 3.27 | -35.01 | 2 | 4 | 1 | 29 | 242.387 | 4 | ↓ |
