| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2010 | 16 | Yes |
Popular Name: (2S)-1-(ethylamino)-3-[methyl-[(2-methylthiazol-4-yl)methyl]amino]propan-2-ol (2S)-1-(ethylamino)-3-[methyl-[(…
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| 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) | -0.21 | 2.89 | -102.14 | 4 | 4 | 2 | 54 | 245.392 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.21 | -0.88 | -5.5 | 2 | 4 | 0 | 48 | 243.376 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.21 | 3.44 | -39.05 | 3 | 4 | 1 | 57 | 244.384 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.21 | 0.49 | -41.89 | 3 | 4 | 1 | 53 | 244.384 | 7 | ↓ |
