In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 16 | Yes |
Popular Name: (1S,2R)-2-[(3S)-3-(diethylamino)pyrrolidin-1-yl]cyclopentanol (1S,2R)-2-[(3S)-3-(diethylamino)…
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) | 1.49 | 3.7 | -30.61 | 2 | 3 | 1 | 28 | 227.372 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.49 | 5.88 | -96.39 | 3 | 3 | 2 | 29 | 228.38 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.49 | 3.73 | -27.88 | 2 | 3 | 1 | 28 | 227.372 | 4 | ↓ |