In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 17 | Yes |
Popular Name: (S)-(2,5-dibromo-3-thienyl)-(4-ethylphenyl)methanamine (S)-(2,5-dibromo-3-thienyl)-(4-e…
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) | 5.27 | 7.98 | -45.06 | 3 | 1 | 1 | 28 | 376.137 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.27 | 7.67 | -2.1 | 2 | 1 | 0 | 26 | 375.129 | 3 | ↓ |