| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2010 | 18 | No |
Popular Name: (3S)-1-[(2-methyl-3-nitro-phenyl)methyl]piperidin-3-ol (3S)-1-[(2-methyl-3-nitro-phenyl…
| 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) | 1.81 | 6.13 | -46.76 | 2 | 5 | 1 | 70 | 251.306 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 4.36 | -8.01 | 1 | 5 | 0 | 69 | 250.298 | 3 | ↓ |
