| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2010 | 13 | Yes |
Popular Name: (3S)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]butanamidine (3S)-3-[(2R)-2-(hydroxymethyl)py…
| 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) | -0.21 | -0.2 | -96.17 | 6 | 4 | 2 | 76 | 187.287 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.21 | -2.12 | -31.59 | 5 | 4 | 1 | 75 | 186.279 | 4 | ↓ |
