In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 30 | Yes |
Popular Name: [2-[(4-cinnamylpiperazin-1-yl)methyl]oxazol-4-yl]-[(3R)-3-hydroxy-1-piperidyl]methanone [2-[(4-cinnamylpiperazin-1-yl)me…
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) | 1.95 | 5.74 | -52.36 | 2 | 7 | 1 | 74 | 411.526 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 5.74 | -53.3 | 2 | 7 | 1 | 74 | 411.526 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 3.42 | -10.97 | 1 | 7 | 0 | 73 | 410.518 | 6 | ↓ |