| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 18 | Yes |
Popular Name: (1S)-1-(5-chloro-2-thienyl)-N-cycloheptyl-N-methyl-ethane-1,2-diamine (1S)-1-(5-chloro-2-thienyl)-N-cy…
| 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) | 3.84 | 5.25 | -47.51 | 3 | 2 | 1 | 31 | 287.88 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.84 | 4.92 | -1.21 | 2 | 2 | 0 | 29 | 286.872 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.84 | 7.24 | -133.54 | 4 | 2 | 2 | 32 | 288.888 | 4 | ↓ |
