In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 16 | Yes |
Popular Name: 1-[(1R)-2-methyl-1-(2-thienyl)propyl]piperidin-4-one 1-[(1R)-2-methyl-1-(2-thienyl)pr…
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) | 2.52 | 6.46 | -4.84 | 0 | 2 | 0 | 20 | 237.368 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 8.26 | -39.03 | 1 | 2 | 1 | 22 | 238.376 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.