In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2010 | 25 | Yes |
Popular Name: 3-cyclopentyl-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]propan-1-one 3-cyclopentyl-1-[4-(2-isopropyl-…
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) | 3.36 | 10.99 | -12.26 | 0 | 5 | 0 | 49 | 344.503 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 11.47 | -35.37 | 1 | 5 | 1 | 51 | 345.511 | 5 | ↓ |