In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (2S,5R)-4-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-5-ethyl-2-methyl-morpholine (2S,5R)-4-[(5-chloro-1,3-dimethy…
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) | 2.22 | 4.09 | -5.3 | 0 | 4 | 0 | 30 | 271.792 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.22 | 6.22 | -33.45 | 1 | 4 | 1 | 31 | 272.8 | 3 | ↓ |