In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 18 | Yes |
Popular Name: (1R,2R,4S)-2-[(2S)-2-ethylpyrrolidin-1-yl]-N-methyl-4-propyl-cyclohexanamine (1R,2R,4S)-2-[(2S)-2-ethylpyrrol…
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) | 4.03 | 9.44 | -101.71 | 3 | 2 | 2 | 21 | 254.462 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.03 | 9.14 | -27.01 | 2 | 2 | 1 | 16 | 253.454 | 5 | ↓ |