In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2009 | 28 | Yes |
Popular Name: (1S,2S)-2-[4-[2-(3-methoxyphenoxy)ethyl]piperazine-1-carbonyl]cyclohexane-1-carboxylic (1S,2S)-2-[4-[2-(3-methoxyphenox…
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) | 2.67 | 6.84 | -63.08 | 0 | 7 | -1 | 82 | 389.472 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 9.17 | -76.3 | 1 | 7 | 0 | 83 | 390.48 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 8.05 | -48.81 | 2 | 7 | 1 | 81 | 391.488 | 7 | ↓ |