| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2008 | 21 | Yes |
Popular Name: 2-[(2S)-1-isopentyl-4-[(2-methylthiazol-5-yl)methyl]piperazin-2-yl]ethanol 2-[(2S)-1-isopentyl-4-[(2-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) | 1.80 | 4.34 | -38.43 | 2 | 4 | 1 | 41 | 312.503 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 2.17 | -6.36 | 1 | 4 | 0 | 40 | 311.495 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 4.45 | -41.2 | 2 | 4 | 1 | 41 | 312.503 | 7 | ↓ |
