| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: 2-[[(1R,2R)-2-amino-1-(3-methyl-2-thienyl)propyl]-cyclopentyl-amino]ethanol 2-[[(1R,2R)-2-amino-1-(3-methyl-…
| 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) | 2.17 | 3.35 | -25.45 | 4 | 3 | 1 | 51 | 283.461 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 1.9 | -3.69 | 3 | 3 | 0 | 49 | 282.453 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 2.21 | -40.71 | 4 | 3 | 1 | 51 | 283.461 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 3.66 | -100.49 | 5 | 3 | 2 | 52 | 284.469 | 6 | ↓ |
