In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2012 | 22 | Yes |
Popular Name: (3S,5S)-5-(3-methoxyphenyl)-1-methyl-3-(1-piperidylmethyl)pyrrolidin-2-one (3S,5S)-5-(3-methoxyphenyl)-1-me…
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) | 2.72 | 9.19 | -38.17 | 1 | 4 | 1 | 34 | 303.426 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 7 | -9.03 | 0 | 4 | 0 | 33 | 302.418 | 4 | ↓ |