In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 17 | Yes |
Popular Name: 3-[[(1R)-2-amino-1-(1-methylpyrazol-4-yl)ethyl]-isopropyl-amino]propan-1-ol 3-[[(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) | -0.58 | -0.61 | -52.79 | 4 | 5 | 1 | 69 | 241.359 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.58 | 1.12 | -124.91 | 5 | 5 | 2 | 70 | 242.367 | 7 | ↓ |