In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: N-methyl-2-piperazin-1-yl-N-(4-pyridylmethyl)acetamide N-methyl-2-piperazin-1-yl-N-(4-p…
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) | -0.90 | 2.65 | -43.21 | 2 | 5 | 1 | 53 | 249.338 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.90 | 1.28 | -10.18 | 1 | 5 | 0 | 48 | 248.33 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.90 | 3.1 | -83.68 | 3 | 5 | 2 | 54 | 250.346 | 4 | ↓ |