In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 19 | Yes |
Popular Name: (2R)-1-(4-isopropylphenyl)-2-piperazin-1-yl-propan-1-one (2R)-1-(4-isopropylphenyl)-2-pip…
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) | 2.63 | 6.06 | -41.25 | 2 | 3 | 1 | 37 | 261.389 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.63 | 4.72 | -6.57 | 1 | 3 | 0 | 32 | 260.381 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 6.88 | -33 | 2 | 3 | 1 | 34 | 261.389 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.63 | 8.28 | -116.04 | 3 | 3 | 2 | 38 | 262.397 | 4 | ↓ |