In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 15 | Yes |
Popular Name: (1R)-1-(5-bromo-2-thienyl)-N-butyl-N-methyl-ethane-1,2-diamine (1R)-1-(5-bromo-2-thienyl)-N-but…
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) | 3.00 | 4.88 | -41.59 | 3 | 2 | 1 | 31 | 292.266 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 6.86 | -123.17 | 4 | 2 | 2 | 32 | 293.274 | 6 | ↓ |