In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2008 | 30 | Yes |
Popular Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-3-[1-(4-quinolylmethyl)-4-piperidyl]propanamide N-[[(2S)-1-ethylpyrrolidin-2-yl]…
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) | 3.38 | -1.17 | -96.26 | 3 | 5 | 2 | 51 | 410.606 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.38 | -1.07 | -156.45 | 4 | 5 | 3 | 52 | 411.614 | 8 | ↓ |