In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: N-[(S)-(5-chloro-2-thienyl)-(2-thienyl)methyl]-2-pyrrolidin-1-yl-ethanamine N-[(S)-(5-chloro-2-thienyl)-(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) | 4.31 | 8.92 | -35.86 | 2 | 2 | 1 | 16 | 327.926 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.31 | 6.46 | -3.34 | 1 | 2 | 0 | 15 | 326.918 | 6 | ↓ |