In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 3rd, 2011 | 23 | No |
Popular Name: 2-[1-[(4-methoxy-3-nitro-phenyl)methyl]-4-piperidyl]-N,N-dimethyl-ethanamine 2-[1-[(4-methoxy-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) | 2.94 | 11.61 | -106.24 | 2 | 6 | 2 | 64 | 323.437 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 9.37 | -43.95 | 1 | 6 | 1 | 63 | 322.429 | 7 | ↓ |