In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 20 | Yes |
Popular Name: 6-isopropyl-N-propyl-2-(4-pyridylmethyl)pyrimidin-4-amine 6-isopropyl-N-propyl-2-(4-pyridy…
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) | 3.15 | 7.45 | -6.8 | 1 | 4 | 0 | 51 | 270.38 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.15 | 7.94 | -31.78 | 2 | 4 | 1 | 52 | 271.388 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.15 | 7.91 | -32.23 | 2 | 4 | 1 | 52 | 271.388 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.15 | 8.4 | -80.35 | 3 | 4 | 2 | 53 | 272.396 | 6 | ↓ |