In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2011 | 26 | Yes |
Popular Name: 1-(4-methylpiperazin-1-yl)-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]ethanone 1-(4-methylpiperazin-1-yl)-2-[(6…
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) | 2.44 | 9.83 | -48.86 | 2 | 6 | 1 | 63 | 368.486 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 7.48 | -10.21 | 1 | 6 | 0 | 61 | 367.478 | 4 | ↓ |