| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 20 | Yes |
Popular Name: (1S)-N-benzyl-1-(4-bromo-2-thienyl)-N-cyclopropyl-ethane-1,2-diamine (1S)-N-benzyl-1-(4-bromo-2-thien…
| 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) | 3.13 | 8.77 | -118.92 | 4 | 2 | 2 | 32 | 353.329 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 6.68 | -3.15 | 2 | 2 | 0 | 29 | 351.313 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 6.93 | -53.65 | 3 | 2 | 1 | 31 | 352.321 | 6 | ↓ |
