In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 26 | Yes |
Popular Name: [(2S)-1-(4-anilinopyrimidin-2-yl)pyrrolidin-2-yl]-[(2S)-2-methylpyrrolidin-1-yl]methanone [(2S)-1-(4-anilinopyrimidin-2-yl…
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) | 3.56 | 11.97 | -16.45 | 1 | 6 | 0 | 61 | 351.454 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 12.32 | -33.88 | 2 | 6 | 1 | 63 | 352.462 | 4 | ↓ |