In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 20 | Yes |
Popular Name: 2-[4-[[(2S,4R,5R)-1,2,5-trimethyl-4-piperidyl]amino]-1-piperidyl]acetamide 2-[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) | 0.48 | 4.74 | -187.68 | 6 | 5 | 3 | 69 | 285.456 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 1.68 | -39.24 | 4 | 5 | 1 | 63 | 283.44 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 3.88 | -83.5 | 5 | 5 | 2 | 64 | 284.448 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.48 | 2.55 | -105.68 | 5 | 5 | 2 | 67 | 284.448 | 4 | ↓ |