In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 24 | Yes |
Popular Name: N-ethyl-2-isopropyl-N-[2-(4-pyridyl)ethyl]quinazolin-4-amine N-ethyl-2-isopropyl-N-[2-(4-pyri…
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) | 3.80 | 11.34 | -9.15 | 0 | 4 | 0 | 42 | 320.44 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.80 | 11.84 | -27.47 | 1 | 4 | 1 | 43 | 321.448 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.80 | 11.8 | -38.47 | 1 | 4 | 1 | 43 | 321.448 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.80 | 12.3 | -70.14 | 2 | 4 | 2 | 44 | 322.456 | 6 | ↓ |