In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 19 | Yes |
Popular Name: (2S)-N-ethyl-2-[[(1R)-1-[(3S)-1-propyl-3-piperidyl]ethyl]amino]propanamide (2S)-N-ethyl-2-[[(1R)-1-[(3S)-1-…
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) | 1.92 | 6.16 | -101.19 | 4 | 4 | 2 | 50 | 271.449 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.92 | 5.25 | -39.68 | 3 | 4 | 1 | 46 | 270.441 | 7 | ↓ |