In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 21st, 2011 | 25 | No |
Popular Name: 2-piperazineacetic acid, 1-[2-(methylphenylamino)-2-oxoethyl]-3-oxo-, propyl ester 2-piperazineacetic acid, 1-[2-(m…
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) | 1.05 | 6.35 | -18.82 | 1 | 7 | 0 | 79 | 347.415 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.05 | 7.48 | -51.47 | 2 | 7 | 1 | 80 | 348.423 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.