| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | Yes |
Popular Name: 2-[[(1R)-2-amino-1-(1-methylpyrazol-4-yl)ethyl]-(1-ethylpropyl)amino]ethanol 2-[[(1R)-2-amino-1-(1-methylpyra…
| 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) | 0.22 | 1.22 | -28.54 | 4 | 5 | 1 | 69 | 255.386 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.22 | -0.09 | -5.1 | 3 | 5 | 0 | 67 | 254.378 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | -0.01 | -44.03 | 4 | 5 | 1 | 69 | 255.386 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 0.22 | 1.02 | -120.19 | 5 | 5 | 2 | 70 | 256.394 | 8 | ↓ |
