In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 21st, 2011 | 23 | No |
Popular Name: 2-piperazineacetic acid, 3-oxo-1-[2-oxo-2-(1-piperidinyl)ethyl]-, propyl ester 2-piperazineacetic acid, 3-oxo-1…
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) | 0.26 | 4.87 | -16.8 | 1 | 7 | 0 | 79 | 325.409 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.26 | 6 | -48.65 | 2 | 7 | 1 | 80 | 326.417 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.