In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2009 | 15 | Yes |
Popular Name: (2S)-1-(2-dimethylaminoethylamino)-3-pyrrolidin-1-yl-propan-2-ol (2S)-1-(2-dimethylaminoethylamin…
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) | -0.44 | 1.18 | -100.87 | 4 | 4 | 2 | 45 | 217.357 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.43 | 2.29 | -79.11 | 4 | 4 | 2 | 41 | 217.357 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.44 | 3.65 | -187.02 | 5 | 4 | 3 | 46 | 218.365 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.44 | -1.36 | -38.9 | 3 | 4 | 1 | 43 | 216.349 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.44 | 4.18 | -104.07 | 4 | 4 | 2 | 49 | 217.357 | 7 | ↓ |