In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2011 | 23 | Yes |
Popular Name: 1-(4-methylpiperazin-1-yl)-2-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]ethanone 1-(4-methylpiperazin-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) | 1.21 | 7.62 | -49.07 | 2 | 6 | 1 | 63 | 334.469 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 5.28 | -10.51 | 1 | 6 | 0 | 61 | 333.461 | 3 | ↓ |