In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 20 | Yes |
Popular Name: 4-methyl-1-[3-(4-pyridylmethyl)-1,2,4-oxadiazol-5-yl]cyclohexanamine 4-methyl-1-[3-(4-pyridylmethyl)-…
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) | 1.84 | 2.99 | -52.91 | 3 | 5 | 1 | 79 | 273.36 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.84 | 3.45 | -93.81 | 4 | 5 | 2 | 81 | 274.368 | 3 | ↓ |