In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2011 | 24 | Yes |
Popular Name: 1-(4-ethylpiperazin-1-yl)-2-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]ethanone 1-(4-ethylpiperazin-1-yl)-2-[(2,…
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) | 1.58 | 8.28 | -47.94 | 2 | 6 | 1 | 63 | 348.496 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 6.06 | -10.33 | 1 | 6 | 0 | 61 | 347.488 | 4 | ↓ |