In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 21 | Yes |
Popular Name: (2S)-2-[2,4-dichloro-6-(methylaminomethyl)phenoxy]-1-pyrrolidin-1-yl-propan-1-one (2S)-2-[2,4-dichloro-6-(methylam…
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) | 2.88 | 7.96 | -39.08 | 2 | 4 | 1 | 46 | 332.251 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 6.49 | -8.24 | 1 | 4 | 0 | 42 | 331.243 | 5 | ↓ |