In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 21 | No |
Popular Name: (2S)-2-[4-(1,3-dioxolan-2-yl)-1-piperidyl]-N-(ethylcarbamoyl)propanamide (2S)-2-[4-(1,3-dioxolan-2-yl)-1-…
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) | 0.38 | 4 | -48.26 | 3 | 7 | 1 | 81 | 300.379 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.38 | 1.8 | -19.2 | 2 | 7 | 0 | 80 | 299.371 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.