In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 18 | Yes |
Popular Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-4-propyl-cyclohexan-1-amine N-[[(2S)-1-ethylpyrrolidin-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) | 3.82 | 7.08 | -39.84 | 2 | 2 | 1 | 20 | 253.454 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.82 | 8.17 | -29.73 | 2 | 2 | 1 | 16 | 253.454 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.82 | 9.46 | -110.91 | 3 | 2 | 2 | 21 | 254.462 | 6 | ↓ |