In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 21 | Yes |
Popular Name: 2-[methyl(4-piperidyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[methyl(4-piperidyl)amino]-N-(…
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) | 1.83 | 4.7 | -48.34 | 3 | 4 | 1 | 49 | 308.471 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 3.36 | -9.59 | 2 | 4 | 0 | 44 | 307.463 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 6.93 | -110.97 | 4 | 4 | 2 | 50 | 309.479 | 7 | ↓ |