In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2009 | 24 | Yes |
Popular Name: [(1R)-cyclohex-3-en-1-yl]-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]methanone [(1R)-cyclohex-3-en-1-yl]-[4-(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) | 2.84 | 9.9 | -9.26 | 0 | 5 | 0 | 49 | 328.46 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 10.38 | -32.1 | 1 | 5 | 1 | 51 | 329.468 | 3 | ↓ |