| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 14 | Yes |
Popular Name: (3R)-N1-[(3S)-1-cyclopropylpyrrolidin-3-yl]butane-1,3-diamine (3R)-N1-[(3S)-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 | 2.95 | -86.34 | 5 | 3 | 2 | 44 | 199.342 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.09 | 3.83 | -107.11 | 5 | 3 | 2 | 47 | 199.342 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.09 | 1.45 | -36.03 | 4 | 3 | 1 | 46 | 198.334 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.09 | 2.62 | -30.2 | 4 | 3 | 1 | 42 | 198.334 | 5 | ↓ |
