In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 26 | No |
Popular Name: [5-[2-(4-ethylphenyl)-4-pyridyl]-4-(2-pyridyl)thiazol-2-yl]amine [5-[2-(4-ethylphenyl)-4-pyridyl]…
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) | 4.44 | -1.61 | -10.67 | 2 | 4 | 0 | 64 | 358.47 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.44 | -1.22 | -170.58 | 5 | 4 | 3 | 68 | 361.494 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.44 | -1.35 | -92.2 | 4 | 4 | 2 | 67 | 360.486 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.44 | -1.34 | -85.37 | 4 | 4 | 2 | 67 | 360.486 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.44 | -1.48 | -30.18 | 3 | 4 | 1 | 65 | 359.478 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.44 | -1.35 | -80.77 | 4 | 4 | 2 | 67 | 360.486 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.44 | -1.48 | -36.52 | 3 | 4 | 1 | 65 | 359.478 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.44 | -1.47 | -32.16 | 3 | 4 | 1 | 65 | 359.478 | 4 | ↓ |