In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 24 | Yes |
Popular Name: (2S)-N-(3-chloro-2-methyl-phenyl)-2-[(3S)-3-(1,3-dioxolan-2-yl)-1-piperidyl]propanamide (2S)-N-(3-chloro-2-methyl-phenyl…
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) | 3.08 | 7.99 | -38.62 | 2 | 5 | 1 | 52 | 353.87 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.08 | 5.83 | -10.39 | 1 | 5 | 0 | 51 | 352.862 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.