In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 19 | Yes |
Popular Name: 2-[(2S)-4-[(4-isopropylthiazol-2-yl)methyl]-1-methyl-piperazin-2-yl]ethanol 2-[(2S)-4-[(4-isopropylthiazol-2…
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) | 1.20 | 2.59 | -38.21 | 2 | 4 | 1 | 41 | 284.449 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 0.22 | -7.48 | 1 | 4 | 0 | 40 | 283.441 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 2.62 | -38.63 | 2 | 4 | 1 | 41 | 284.449 | 5 | ↓ |