In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 17 | Yes |
Popular Name: (2S,6R)-2,6-dimethyl-1-[(1-propyltetrazol-5-yl)methyl]piperazine (2S,6R)-2,6-dimethyl-1-[(1-propy…
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) | 0.06 | 1.56 | -44.14 | 2 | 6 | 1 | 63 | 239.347 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.06 | 0.23 | -10.2 | 1 | 6 | 0 | 59 | 238.339 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.