| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2010 | 15 | Yes |
Popular Name: (3S)-N1-[(1S,2R)-2-phenylcyclopropyl]butane-1,3-diamine (3S)-N1-[(1S,2R)-2-phenylcyclopr…
| 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) | 1.28 | 5.37 | -114 | 5 | 2 | 2 | 44 | 206.333 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 4.1 | -40.5 | 4 | 2 | 1 | 40 | 205.325 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 5.05 | -40.4 | 4 | 2 | 1 | 43 | 205.325 | 5 | ↓ |
