In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 17 | Yes |
Popular Name: 3-[(5-bromo-2-thienyl)methylamino]-1-pyrrolidin-1-yl-propan-1-one 3-[(5-bromo-2-thienyl)methylamin…
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) | 2.35 | 6.64 | -50.42 | 2 | 3 | 1 | 37 | 318.26 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 5.22 | -8.34 | 1 | 3 | 0 | 32 | 317.252 | 5 | ↓ |