In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2011 | 14 | Yes |
Popular Name: 4,4-dimethyl-1-[[(2R)-pyrrolidin-2-yl]methyl]piperidine 4,4-dimethyl-1-[[(2R)-pyrrolidin…
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) | 2.08 | 6.77 | -112.43 | 3 | 2 | 2 | 21 | 198.354 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.08 | 4.4 | -32.23 | 2 | 2 | 1 | 20 | 197.346 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 5.43 | -31.58 | 2 | 2 | 1 | 16 | 197.346 | 2 | ↓ |