In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 21 | Yes |
Popular Name: 2-cyclopentyl-1-[4-[(2R)-3-ethoxy-2-hydroxy-propyl]piperazin-1-yl]ethanone 2-cyclopentyl-1-[4-[(2R)-3-ethox…
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) | 1.32 | 3.08 | -10.99 | 1 | 5 | 0 | 53 | 298.427 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.32 | 5.35 | -48.05 | 2 | 5 | 1 | 54 | 299.435 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.