| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: N'-isopropyl-N'-methyl-N-[(1S)-1-(2-thienyl)ethyl]butane-1,4-diamine N'-isopropyl-N'-methyl-N-[(1S)-1…
| 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) | 3.20 | 8.92 | -92.14 | 3 | 2 | 2 | 21 | 256.459 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.20 | 7.71 | -32.33 | 2 | 2 | 1 | 16 | 255.451 | 8 | ↓ |
