In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 15 | No |
Popular Name: (3S)-1-(2-chloroallyl)-3-(1,3-dioxolan-2-yl)piperidine (3S)-1-(2-chloroallyl)-3-(1,3-di…
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) | 1.90 | 3.71 | -3.99 | 0 | 3 | 0 | 22 | 231.723 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.90 | 6 | -32.91 | 1 | 3 | 1 | 23 | 232.731 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.