In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 17 | Yes |
Popular Name: (2S)-2-[[(2R)-3-methoxy-2-methyl-propyl]amino]-1-(1-piperidyl)propan-1-one (2S)-2-[[(2R)-3-methoxy-2-methyl…
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) | 1.42 | 4.76 | -40.7 | 2 | 4 | 1 | 46 | 243.371 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.42 | 3.61 | -9.11 | 1 | 4 | 0 | 42 | 242.363 | 6 | ↓ |