In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2010 | 20 | Yes |
Popular Name: 2-[[3-hydroxypropyl(isopropyl)amino]methyl]-3H-quinazolin-4-one 2-[[3-hydroxypropyl(isopropyl)am…
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) | 1.21 | 2.3 | -11.6 | 2 | 5 | 0 | 69 | 275.352 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 1.38 | -44.57 | 2 | 5 | 0 | 74 | 275.352 | 6 | ↓ |