In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 33 | Yes |
Popular Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-N-(2-dimethylaminoethyl)oxazole-4-carboxamide 2-[(4-benzhydrylpiperazin-1-yl)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) | 2.80 | 6.82 | -41.38 | 2 | 7 | 1 | 66 | 448.591 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 4.34 | -8.41 | 1 | 7 | 0 | 65 | 447.583 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 9.12 | -95.39 | 3 | 7 | 2 | 67 | 449.599 | 9 | ↓ |