In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 15 | Yes |
Popular Name: 3-[[(1S)-1-[(3S)-1-methyl-3-piperidyl]ethyl]amino]propanamide 3-[[(1S)-1-[(3S)-1-methyl-3-pipe…
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) | 0.23 | 2.57 | -101.77 | 5 | 4 | 2 | 64 | 215.341 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.23 | 1.36 | -39.51 | 4 | 4 | 1 | 60 | 214.333 | 5 | ↓ |