In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 25 | Yes |
Popular Name: N,N-diethyl-3-[[(2S)-2-[(3S)-3-hydroxy-1-piperidyl]propanoyl]amino]benzamide N,N-diethyl-3-[[(2S)-2-[(3S)-3-h…
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) | 0.93 | 5.62 | -41.54 | 3 | 6 | 1 | 74 | 348.467 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.11 | 1.75 | -49.27 | 1 | 6 | -1 | 79 | 346.451 | 6 | ↓ |