| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 19 | Yes |
Popular Name: (1R,2R)-1-(4-bromo-2-thienyl)-N1-ethyl-N1-(2-thienylmethyl)propane-1,2-diamine (1R,2R)-1-(4-bromo-2-thienyl)-N1…
| 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) | 3.44 | 6.27 | -45.12 | 3 | 2 | 1 | 31 | 360.366 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 5.95 | -2.37 | 2 | 2 | 0 | 29 | 359.358 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 7.35 | -32.13 | 3 | 2 | 1 | 30 | 360.366 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 7.66 | -114.89 | 4 | 2 | 2 | 32 | 361.374 | 6 | ↓ |
