In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 33 | Yes |
Popular Name: (4-phenylpiperazin-1-yl)-[2-[[4-(3-pyridylmethyl)piperazin-1-yl]methyl]oxazol-4-yl]methanone (4-phenylpiperazin-1-yl)-[2-[[4-…
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) | 1.59 | 7.91 | -51.81 | 1 | 8 | 1 | 70 | 447.563 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 7.87 | -48.65 | 1 | 8 | 1 | 70 | 447.563 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 5.63 | -10.57 | 0 | 8 | 0 | 69 | 446.555 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 8.38 | -100.2 | 2 | 8 | 2 | 71 | 448.571 | 6 | ↓ |