In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 16 | Yes |
Popular Name: (2S)-3,3-dimethyl-1-[(2S)-2-methylpyrrolidin-1-yl]-N-propyl-butan-2-amine (2S)-3,3-dimethyl-1-[(2S)-2-meth…
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) | 3.43 | 7.99 | -106.14 | 3 | 2 | 2 | 21 | 228.424 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.43 | 7.88 | -30.14 | 2 | 2 | 1 | 20 | 227.416 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.43 | 8.07 | -28.08 | 2 | 2 | 1 | 16 | 227.416 | 6 | ↓ |