In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 32 | Yes |
Popular Name: 1-[(3R)-1-[2-[(4-cinnamylpiperazin-1-yl)methyl]oxazole-4-carbonyl]-3-piperidyl]ethanone 1-[(3R)-1-[2-[(4-cinnamylpiperaz…
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) | 2.51 | 9.63 | -50.63 | 1 | 7 | 1 | 71 | 437.564 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 9.62 | -53.11 | 1 | 7 | 1 | 71 | 437.564 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 7.31 | -11.65 | 0 | 7 | 0 | 70 | 436.556 | 7 | ↓ |