In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 19 | Yes |
Popular Name: N-[(1S)-1-(5-bromo-2-thienyl)ethyl]-3-(cyclohexoxy)propan-1-amine N-[(1S)-1-(5-bromo-2-thienyl)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) | 5.05 | 9.09 | -41.13 | 2 | 2 | 1 | 26 | 347.342 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.05 | 7.87 | -2.82 | 1 | 2 | 0 | 21 | 346.334 | 7 | ↓ |