In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 22 | Yes |
Popular Name: 1-[(4-ethylphenyl)methyl]-4-[(1R,2S,4S)-norbornan-2-yl]piperazine 1-[(4-ethylphenyl)methyl]-4-[(1R…
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) | 4.08 | 10.92 | -32.06 | 1 | 2 | 1 | 8 | 299.482 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.08 | 9.27 | -1.72 | 0 | 2 | 0 | 6 | 298.474 | 4 | ↓ |