In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2010 | 28 | Yes |
Popular Name: N-(1-benzyl-4-piperidyl)-4-(1,4-diazepan-1-yl)-6-methyl-pyrimidin-2-amine N-(1-benzyl-4-piperidyl)-4-(1,4-…
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) | 2.66 | 13.07 | -88.52 | 4 | 6 | 2 | 62 | 382.556 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 13.39 | -161.36 | 5 | 6 | 3 | 63 | 383.564 | 5 | ↓ |