| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 17 | Yes |
Popular Name: (1R)-1-(5-chloro-2-thienyl)-N-methyl-N-(2-thienylmethyl)ethane-1,2-diamine (1R)-1-(5-chloro-2-thienyl)-N-me…
| 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) | 2.73 | 4.83 | -50.68 | 3 | 2 | 1 | 31 | 287.861 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.73 | 3.99 | -3.46 | 2 | 2 | 0 | 29 | 286.853 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 6.49 | -35.21 | 3 | 2 | 1 | 30 | 287.861 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 6.83 | -123.6 | 4 | 2 | 2 | 32 | 288.869 | 5 | ↓ |
