In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-N-[(1R)-1-methylpropyl]ethane-1,2-diamine (1R)-1-(2,3-dihydro-1,4-benzodio…
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) | 1.45 | 5.42 | -123.28 | 4 | 4 | 2 | 51 | 266.385 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.45 | 3.57 | -47.61 | 3 | 4 | 1 | 49 | 265.377 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.45 | 5.58 | -31.52 | 3 | 4 | 1 | 49 | 265.377 | 5 | ↓ |