In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 19 | Yes |
Popular Name: (1S,2S)-1-(4-chlorophenyl)-1-(p-tolylsulfanyl)propan-2-amine (1S,2S)-1-(4-chlorophenyl)-1-(p-…
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) | 4.29 | 8.85 | -46.24 | 3 | 1 | 1 | 28 | 292.855 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.29 | 9.07 | -3.46 | 2 | 1 | 0 | 26 | 291.847 | 4 | ↓ |