In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 20 | Yes |
Popular Name: 2-[[4-(dimethylamino)butylamino]methyl]-3H-quinazolin-4-one 2-[[4-(dimethylamino)butylamino]…
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) | 1.22 | 4.93 | -49.75 | 3 | 5 | 1 | 62 | 275.376 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 4.22 | -90.21 | 3 | 5 | 1 | 70 | 275.376 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.22 | 6.78 | -110.3 | 4 | 5 | 2 | 67 | 276.384 | 7 | ↓ |