In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2009 | 20 | Yes |
Popular Name: (2S)-N-[(1R)-1-(1-methylcyclopropyl)ethyl]-2-phenyl-2-pyrrolidin-1-yl-ethanamine (2S)-N-[(1R)-1-(1-methylcyclopro…
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) | 3.27 | 11.01 | -112.26 | 3 | 2 | 2 | 21 | 274.452 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.27 | 8.55 | -35.25 | 2 | 2 | 1 | 20 | 273.444 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.27 | 11.29 | -30.61 | 2 | 2 | 1 | 16 | 273.444 | 6 | ↓ |