In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 24 | Yes |
Popular Name: [2-(4-ethylpiperazin-1-yl)-4-methyl-pyrimidin-5-yl]-(4-methylpiperazin-1-yl)methanone [2-(4-ethylpiperazin-1-yl)-4-met…
None
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) | 0.30 | 8.4 | -89.31 | 2 | 7 | 2 | 58 | 334.468 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 6.01 | -40.88 | 1 | 7 | 1 | 57 | 333.46 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 6.09 | -46.67 | 1 | 7 | 1 | 57 | 333.46 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 3.7 | -7.07 | 0 | 7 | 0 | 56 | 332.452 | 3 | ↓ |