In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 18th, 2009 | 19 | Yes |
Popular Name: 4-[(2S)-3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazin-2-one 4-[(2S)-3-(4-chlorophenoxy)-2-hy…
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) | 1.53 | 2.56 | -54.23 | 3 | 5 | 1 | 63 | 285.751 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.53 | 0.16 | -11.46 | 2 | 5 | 0 | 62 | 284.743 | 5 | ↓ |