In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 28 | Yes |
Popular Name: (3R)-N-(2-diethylaminoethyl)-1-(2-phenylpyrimidin-4-yl)piperidine-3-carboxamide (3R)-N-(2-diethylaminoethyl)-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) | 3.02 | 10.05 | -49.11 | 2 | 6 | 1 | 63 | 382.532 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.02 | 7.82 | -17.26 | 1 | 6 | 0 | 61 | 381.524 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.02 | 10.39 | -82.56 | 3 | 6 | 2 | 64 | 383.54 | 8 | ↓ |