In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2010 | 20 | Yes |
Popular Name: 2-[4-(1,2-benzoxazol-3-yl)-1-piperidyl]-N,N-dimethyl-ethanamine 2-[4-(1,2-benzoxazol-3-yl)-1-pip…
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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) | 2.40 | 7.05 | -44 | 1 | 4 | 1 | 34 | 274.388 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 7.3 | -42.22 | 1 | 4 | 1 | 34 | 274.388 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 9.53 | -120.21 | 2 | 4 | 2 | 35 | 275.396 | 4 | ↓ |