In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 24th, 2011 | 19 | Yes |
Popular Name: (1R)-N-methyl-N-[(1-methyl-4-piperidyl)methyl]-1-(3-methyl-2-thienyl)ethane-1,2-diamine (1R)-N-methyl-N-[(1-methyl-4-pip…
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 | 6.6 | -95.98 | 4 | 3 | 2 | 35 | 283.485 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.81 | 5.77 | -32.56 | 3 | 3 | 1 | 34 | 282.477 | 5 | ↓ |