In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 13 | Yes |
Popular Name: N',N'-dimethyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]ethane-1,2-diamine N',N'-dimethyl-N-[(3-methyl-1,2,…
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) | -0.39 | 0.64 | -40.94 | 2 | 5 | 1 | 55 | 185.251 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.39 | -1.83 | -6.35 | 1 | 5 | 0 | 54 | 184.243 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.39 | -0.46 | -45.69 | 2 | 5 | 1 | 59 | 185.251 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.39 | 1.99 | -119.62 | 3 | 5 | 2 | 60 | 186.259 | 5 | ↓ |