In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 34 | Yes |
Popular Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]propan-1-one 1-(4-benzhydrylpiperazin-1-yl)-3…
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) | 4.19 | 13.01 | -16.1 | 1 | 6 | 0 | 61 | 471.63 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.19 | 14.8 | -54.28 | 2 | 6 | 1 | 63 | 472.638 | 7 | ↓ |