In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 26 | Yes |
Popular Name: 2-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]-N-[2-(3-methylphenoxy)ethyl]acetamide 2-[4-[2-(dimethylamino)acetyl]pi…
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) | 1.30 | 5.34 | -46.07 | 2 | 7 | 1 | 66 | 363.482 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.30 | 2.96 | -15.56 | 1 | 7 | 0 | 65 | 362.474 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.30 | 7.48 | -101.67 | 3 | 7 | 2 | 68 | 364.49 | 8 | ↓ |