In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: 2-[5-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine 2-[5-[[4-(cyclopropylmethyl)pipe…
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) | 0.79 | 2.23 | -94.8 | 4 | 6 | 2 | 74 | 281.404 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.79 | -0.02 | -42.51 | 3 | 6 | 1 | 73 | 280.396 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.79 | -0.26 | -6.29 | 2 | 6 | 0 | 71 | 279.388 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 2.27 | -102.34 | 4 | 6 | 2 | 74 | 281.404 | 5 | ↓ |