In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2011 | 20 | Yes |
Popular Name: 1-[2-[(2S)-6-chloro-2-methyl-chroman-2-yl]ethyl]piperazine 1-[2-[(2S)-6-chloro-2-methyl-chr…
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) | 3.19 | 5.98 | -40.82 | 2 | 3 | 1 | 29 | 295.834 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.19 | 4.62 | -3.75 | 1 | 3 | 0 | 24 | 294.826 | 3 | ↓ |