In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 19 | Yes |
Popular Name: (2S)-2-[[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]methyl]cyclopentanone (2S)-2-[[4-(pyrrolidin-1-ylmethy…
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) | 2.00 | 10.37 | -90.67 | 2 | 3 | 2 | 26 | 266.429 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 8.32 | -34.3 | 1 | 3 | 1 | 25 | 265.421 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.