In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 17 | Yes |
Popular Name: (2S,4S)-N,2-dimethyl-1-[(1-methyl-4-piperidyl)methyl]piperidin-4-amine (2S,4S)-N,2-dimethyl-1-[(1-methy…
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) | 1.65 | 6.05 | -78.93 | 3 | 3 | 2 | 24 | 241.423 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.65 | 6.7 | -89.98 | 3 | 3 | 2 | 21 | 241.423 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 7.96 | -170.6 | 4 | 3 | 3 | 25 | 242.431 | 3 | ↓ |