In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 20 | Yes |
Popular Name: (R)-(5-isopropyl-1,2,4-oxadiazol-3-yl)-(3-propoxyphenyl)methanamine (R)-(5-isopropyl-1,2,4-oxadiazol…
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) | 2.95 | 3.83 | -42.78 | 3 | 5 | 1 | 76 | 276.36 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.95 | 3.51 | -6.97 | 2 | 5 | 0 | 74 | 275.352 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.