In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | Yes |
Popular Name: (2R)-N-[(1R)-1-(dimethylaminomethyl)-3-methyl-butyl]piperidine-2-carboxamide (2R)-N-[(1R)-1-(dimethylaminomet…
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) | 1.77 | 6.19 | -87.6 | 4 | 4 | 2 | 50 | 257.422 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 4.17 | -36.38 | 3 | 4 | 1 | 56 | 256.414 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 5.21 | -39.76 | 3 | 4 | 1 | 46 | 256.414 | 6 | ↓ |