In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2008 | 20 | Yes |
Popular Name: 6-methyl-3-[(4-methylpiperazin-1-yl)methyl]chromen-4-one 6-methyl-3-[(4-methylpiperazin-1…
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) | 1.87 | 6.75 | -36.6 | 1 | 4 | 1 | 38 | 273.356 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 6.61 | -39.77 | 1 | 4 | 1 | 38 | 273.356 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 4.29 | -11.12 | 0 | 4 | 0 | 37 | 272.348 | 2 | ↓ |