In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 20 | Yes |
Popular Name: (3R)-N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1-cyclopropyl-pyrrolidin-3-amine (3R)-N-[(7-chloro-1,3-benzodioxo…
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) | 2.51 | 6.17 | -37.77 | 2 | 4 | 1 | 35 | 295.79 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 3.84 | -5.2 | 1 | 4 | 0 | 34 | 294.782 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.51 | 5.05 | -50.21 | 2 | 4 | 1 | 38 | 295.79 | 4 | ↓ |