In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: 1-[(2S)-2-[[(1S)-1-(5-chloro-2-thienyl)ethyl]amino]propyl]pyrrolidin-2-one 1-[(2S)-2-[[(1S)-1-(5-chloro-2-t…
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) | 2.84 | 7.6 | -41.17 | 2 | 3 | 1 | 37 | 287.836 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 6.36 | -9.76 | 1 | 3 | 0 | 32 | 286.828 | 5 | ↓ |