In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 13 | Yes |
Popular Name: (1R)-1-(4-bromo-2-thienyl)-N-ethyl-N-methyl-ethane-1,2-diamine (1R)-1-(4-bromo-2-thienyl)-N-eth…
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) | 1.74 | 3.31 | -40.1 | 3 | 2 | 1 | 31 | 264.212 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.74 | 2.39 | -2.04 | 2 | 2 | 0 | 29 | 263.204 | 4 | ↓ |