| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 14 | Yes |
Popular Name: (3S)-N1-[(3R)-1-cyclopropylpyrrolidin-3-yl]butane-1,3-diamine (3S)-N1-[(3R)-1-cyclopropylpyrro…
| 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) | 0.09 | 2.85 | -85.47 | 5 | 3 | 2 | 44 | 199.342 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.09 | 3.77 | -102.59 | 5 | 3 | 2 | 47 | 199.342 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.09 | 1.39 | -39.61 | 4 | 3 | 1 | 46 | 198.334 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.09 | 2.56 | -29.43 | 4 | 3 | 1 | 42 | 198.334 | 5 | ↓ |
