In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: 2-[4-[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]-1-piperidyl]-N,N-dimethyl-acetamide 2-[4-[[(2S)-1-ethylpyrrolidin-2-…
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) | 0.22 | 6.31 | -84.92 | 3 | 5 | 2 | 41 | 298.475 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.22 | 4 | -37.87 | 2 | 5 | 1 | 40 | 297.467 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.