In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (1S)-N-cyclopropyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-ethyl-ethane-1,2-diamine (1S)-N-cyclopropyl-1-(2,3-dihydr…
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) | 0.98 | 5.45 | -123.63 | 4 | 4 | 2 | 51 | 264.369 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 5.48 | -31.35 | 3 | 4 | 1 | 49 | 263.361 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 3.05 | -45.22 | 3 | 4 | 1 | 49 | 263.361 | 5 | ↓ |