In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 32 | Yes |
Popular Name: 2-(4-chlorophenoxy)-N-[6-[4-(p-tolylmethyl)piperazin-1-yl]-3-pyridyl]acetamide 2-(4-chlorophenoxy)-N-[6-[4-(p-t…
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) | 4.59 | 13.47 | -49.07 | 2 | 6 | 1 | 59 | 451.978 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.59 | 11.26 | -14.12 | 1 | 6 | 0 | 58 | 450.97 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.59 | 11.58 | -41.4 | 2 | 6 | 1 | 59 | 451.978 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.59 | 13.81 | -109.51 | 3 | 6 | 2 | 60 | 452.986 | 7 | ↓ |