In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: 1-[4-[[(2S,4R,5R)-1,2,5-trimethyl-4-piperidyl]amino]-1-piperidyl]ethanone 1-[4-[[(2S,4R,5R)-1,2,5-trimethy…
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) | 1.10 | 5.86 | -41.13 | 2 | 4 | 1 | 37 | 268.425 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 4.44 | -47.01 | 2 | 4 | 1 | 40 | 268.425 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 6.75 | -114.9 | 3 | 4 | 2 | 41 | 269.433 | 2 | ↓ |