| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 15 | Yes |
Popular Name: (1R)-N-butyl-1-(5-chloro-2-thienyl)-N-methyl-ethane-1,2-diamine (1R)-N-butyl-1-(5-chloro-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) | 2.87 | 4.86 | -40.67 | 3 | 2 | 1 | 31 | 247.815 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 3.6 | -2.11 | 2 | 2 | 0 | 29 | 246.807 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.87 | 6.25 | -121 | 4 | 2 | 2 | 32 | 248.823 | 6 | ↓ |
