| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 23 | Yes |
Popular Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-2-methyl-propan-2-ol 1-[4-[(4-aminoquinazolin-2-yl)me…
| 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) | 1.12 | 1.73 | -10.47 | 3 | 6 | 0 | 79 | 315.421 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 2.04 | -26.56 | 4 | 6 | 1 | 80 | 316.429 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 3.53 | -37.15 | 4 | 6 | 1 | 80 | 316.429 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 3.84 | -79.74 | 5 | 6 | 2 | 81 | 317.437 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
