In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 17 | Yes |
Popular Name: (2R)-N-[(1S)-1-methyl-2-pyrrolidin-1-yl-ethyl]octan-2-amine (2R)-N-[(1S)-1-methyl-2-pyrrolid…
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) | 4.14 | 9.6 | -107.93 | 3 | 2 | 2 | 21 | 242.451 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.14 | 9.2 | -28.97 | 2 | 2 | 1 | 16 | 241.443 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.14 | 9.4 | -30.71 | 2 | 2 | 1 | 20 | 241.443 | 9 | ↓ |