In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 19 | Yes |
Popular Name: 1-(4,5-dimethylthiazol-2-yl)-4-ethyl-N-propyl-cyclohexanamine 1-(4,5-dimethylthiazol-2-yl)-4-e…
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) | 4.11 | 9.33 | -36.22 | 2 | 2 | 1 | 29 | 281.489 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.11 | 8.15 | -2.87 | 1 | 2 | 0 | 25 | 280.481 | 5 | ↓ |