In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 15 | Yes |
Popular Name: [(3S)-1-isopropyl-3-pyrrolidin-1-yl-pyrrolidin-3-yl]methanamine [(3S)-1-isopropyl-3-pyrrolidin-1…
None
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 |
---|---|---|---|---|---|---|---|---|---|---|
Hi High (pH 8-9.5) | 0.44 | 0.32 | -40.66 | 3 | 3 | 1 | 34 | 212.361 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.44 | 2.35 | -30.05 | 3 | 3 | 1 | 34 | 212.361 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 4.39 | -93.81 | 4 | 3 | 2 | 35 | 213.369 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 2.47 | -117.63 | 4 | 3 | 2 | 35 | 213.369 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 2.01 | -26.7 | 3 | 3 | 1 | 34 | 212.361 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.44 | 4.86 | -214.1 | 5 | 3 | 3 | 37 | 214.377 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.44 | 2.72 | -100.76 | 4 | 3 | 2 | 35 | 213.369 | 3 | ↓ |