In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 16 | Yes |
Popular Name: (3R)-1-methyl-N-[(1S)-1-[(3S)-1-methyl-3-piperidyl]ethyl]pyrrolidin-3-amine (3R)-1-methyl-N-[(1S)-1-[(3S)-1-…
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) | 1.38 | 4.71 | -96.14 | 3 | 3 | 2 | 24 | 227.396 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.38 | 2.23 | -36.39 | 2 | 3 | 1 | 23 | 226.388 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.38 | 7.16 | -178.77 | 4 | 3 | 3 | 25 | 228.404 | 3 | ↓ |