In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 19 | Yes |
Popular Name: (3R)-N-(1,3-benzodioxol-5-ylmethyl)-1-cyclopropyl-pyrrolidin-3-amine (3R)-N-(1,3-benzodioxol-5-ylmeth…
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) | 1.90 | 4.54 | -47.93 | 2 | 4 | 1 | 38 | 261.345 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.90 | 3.33 | -5.45 | 1 | 4 | 0 | 34 | 260.337 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.90 | 5.66 | -37.45 | 2 | 4 | 1 | 35 | 261.345 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.90 | 6.87 | -120.29 | 3 | 4 | 2 | 40 | 262.353 | 4 | ↓ |