In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 31 | Yes |
Popular Name: (3S)-N-[(1S)-1-methyl-3-phenyl-propyl]-1-(2-phenylpyrimidin-4-yl)piperidine-3-carboxamide (3S)-N-[(1S)-1-methyl-3-phenyl-p…
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) | 4.88 | 13.97 | -14.31 | 1 | 5 | 0 | 58 | 414.553 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.88 | 14.32 | -37.09 | 2 | 5 | 1 | 59 | 415.561 | 7 | ↓ |