In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: 1-[(2S)-2-[(5-bromo-2-thienyl)methylamino]propyl]pyrrolidin-2-one 1-[(2S)-2-[(5-bromo-2-thienyl)me…
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) | 2.41 | 7.19 | -45.47 | 2 | 3 | 1 | 37 | 318.26 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 5.78 | -8.83 | 1 | 3 | 0 | 32 | 317.252 | 5 | ↓ |