In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 15 | Yes |
Popular Name: (1R,2S)-2-(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)cyclopropanamine (1R,2S)-2-(8-chloro-2,3-dihydro-…
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) | 1.74 | 3.62 | -49.33 | 3 | 3 | 1 | 46 | 226.683 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.74 | 3.29 | -5.64 | 2 | 3 | 0 | 44 | 225.675 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.