In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2010 | 18 | Yes |
Popular Name: N-[[(3S)-1-[(1S)-1-(5-chloro-2-thienyl)ethyl]pyrrolidin-3-yl]methyl]propan-2-amine N-[[(3S)-1-[(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) | 3.96 | 6.76 | -39.35 | 2 | 2 | 1 | 20 | 287.88 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.96 | 9.09 | -103.23 | 3 | 2 | 2 | 21 | 288.888 | 5 | ↓ |