In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 16 | Yes |
Popular Name: (1S,2R)-1-(4-chlorophenyl)-1-pyrrolidin-1-yl-propan-2-amine (1S,2R)-1-(4-chlorophenyl)-1-pyr…
None
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) | 2.21 | 6.92 | -120.82 | 4 | 2 | 2 | 32 | 240.778 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 4.07 | -42.46 | 3 | 2 | 1 | 31 | 239.77 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 6.6 | -34.88 | 3 | 2 | 1 | 30 | 239.77 | 3 | ↓ |