In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 21 | Yes |
Popular Name: 7-chloro-2-[[2-(2-methoxyethoxy)ethylamino]methyl]-3H-quinazolin-4-one 7-chloro-2-[[2-(2-methoxyethoxy)…
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) | 1.08 | 3.83 | -51.98 | 3 | 6 | 1 | 81 | 312.777 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.54 | -0.09 | -44.59 | 1 | 6 | -1 | 79 | 310.761 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 1.26 | -45.19 | 2 | 6 | 0 | 84 | 311.769 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 2.47 | -9.81 | 2 | 6 | 0 | 76 | 311.769 | 8 | ↓ |