In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 12 | Yes |
Popular Name: N-[(1R)-1-(5-bromo-2-thienyl)ethyl]prop-2-en-1-amine N-[(1R)-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) | 3.53 | 6.18 | -37.52 | 2 | 1 | 1 | 17 | 247.181 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 4.98 | -2.17 | 1 | 1 | 0 | 12 | 246.173 | 4 | ↓ |