| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 21 | No |
Popular Name: N-[(2-chloro-5-nitro-phenyl)methyl]-1-isopropyl-piperidin-4-amine N-[(2-chloro-5-nitro-phenyl)meth…
| 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) | 3.15 | 8.67 | -36.71 | 2 | 5 | 1 | 62 | 312.821 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 7.68 | -45.05 | 2 | 5 | 1 | 66 | 312.821 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 9.87 | -113.48 | 3 | 5 | 2 | 67 | 313.829 | 5 | ↓ |
