In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (1S)-1-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-N-ethyl-N-methyl-ethane-1,2-diamine (1S)-1-(5-chloro-2,3-dihydro-1,4…
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) | 1.42 | 2.74 | -47.45 | 3 | 4 | 1 | 49 | 271.768 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 4.7 | -122.64 | 4 | 4 | 2 | 51 | 272.776 | 4 | ↓ |