In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-N'-cyclopentyl-N'-ethyl-ethane-1,2-diamine (1S)-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) | 1.12 | 6.23 | -39.28 | 3 | 4 | 1 | 49 | 277.388 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.12 | 6.57 | -131 | 4 | 4 | 2 | 51 | 278.396 | 5 | ↓ |