In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 15 | Yes |
Popular Name: (3R)-N-[(2S)-2-ethylhexyl]-1-methyl-pyrrolidin-3-amine (3R)-N-[(2S)-2-ethylhexyl]-1-met…
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) | 3.44 | 5.43 | -37.02 | 2 | 2 | 1 | 20 | 213.389 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.44 | 4.32 | -0.55 | 1 | 2 | 0 | 15 | 212.381 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 6.92 | -31.73 | 2 | 2 | 1 | 16 | 213.389 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.44 | 8.16 | -109.45 | 3 | 2 | 2 | 21 | 214.397 | 7 | ↓ |