In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 33 | Yes |
Popular Name: (5-methylpyrazin-2-yl)-[(3R)-3-(4-piperonylpiperazine-1-carbonyl)piperidino]methanone (5-methylpyrazin-2-yl)-[(3R)-3-(…
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) | 1.43 | 6.05 | -15.48 | 0 | 9 | 0 | 88 | 451.527 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 8.26 | -54.54 | 1 | 9 | 1 | 89 | 452.535 | 4 | ↓ |