In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 18 | Yes |
Popular Name: 2-[[(1R)-2-amino-1-(1-methylpyrazol-4-yl)ethyl]-cyclopentyl-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) | -0.13 | 1.58 | -29.29 | 4 | 5 | 1 | 69 | 253.37 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.13 | -0.42 | -7.3 | 3 | 5 | 0 | 67 | 252.362 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.13 | -0.1 | -52.73 | 4 | 5 | 1 | 69 | 253.37 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.13 | 1.64 | -114.57 | 5 | 5 | 2 | 70 | 254.378 | 6 | ↓ |