In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-N'-ethyl-N'-[(1S)-1-methylpropyl]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) | 0.93 | 5.91 | -35.89 | 3 | 4 | 1 | 49 | 265.377 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 6 | -132.19 | 4 | 4 | 2 | 51 | 266.385 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 3.86 | -47.26 | 3 | 4 | 1 | 49 | 265.377 | 6 | ↓ |