| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2008 | 25 | Yes |
Popular Name: 2-[4-[(3S,5R)-3,5-dimethyl-1-piperidyl]quinazolin-2-yl]phenol 2-[4-[(3S,5R)-3,5-dimethyl-1-pip…
| 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) | 5.24 | 10.5 | -9.97 | 1 | 4 | 0 | 49 | 333.435 | 2 | ↓ |
| Hi High (pH 8-9.5) | 5.24 | 10.24 | -56.63 | 0 | 4 | -1 | 52 | 332.427 | 2 | ↓ |
| Mid Mid (pH 6-8) | 5.24 | 11.62 | -35.04 | 1 | 4 | 0 | 53 | 333.435 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.78 | 11.59 | -41.26 | 2 | 4 | 1 | 50 | 334.443 | 1 | ↓ |
