In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-N'-(1-ethylpropyl)-N,N'-dimethyl-ethane-1,2-diamine (1R)-1-(1,3-benzodioxol-5-yl)-N'…
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) | 3.34 | 7.47 | -126.12 | 3 | 4 | 2 | 40 | 280.412 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.34 | 6.09 | -41.84 | 2 | 4 | 1 | 38 | 279.404 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 6.39 | -36.01 | 2 | 4 | 1 | 35 | 279.404 | 7 | ↓ |