In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 20 | Yes |
Popular Name: (2R)-2-[(4-cyclopentylpiperazin-1-yl)methyl]cycloheptanone (2R)-2-[(4-cyclopentylpiperazin-…
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) | 3.09 | 8.71 | -35.23 | 1 | 3 | 1 | 25 | 279.448 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.09 | 6.53 | -5.35 | 0 | 3 | 0 | 24 | 278.44 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.