In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 17 | Yes |
Popular Name: (3R)-1-[(1R,2S,3S)-2,3-dimethylcyclohexyl]-N-propyl-pyrrolidin-3-amine (3R)-1-[(1R,2S,3S)-2,3-dimethylc…
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) | 3.51 | 7.44 | -30.79 | 2 | 2 | 1 | 16 | 239.427 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.51 | 5.47 | -0.39 | 1 | 2 | 0 | 15 | 238.419 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 8.65 | -110.9 | 3 | 2 | 2 | 21 | 240.435 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 6.69 | -35.88 | 2 | 2 | 1 | 20 | 239.427 | 4 | ↓ |