In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 16 | Yes |
Popular Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-N-[(5-methyl-2-thienyl)methyl]amine N-[(1-ethyl-2-pyrrolidinyl)methy…
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 | 7.26 | -28.88 | 2 | 2 | 1 | 16 | 239.408 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 5 | -2.33 | 1 | 2 | 0 | 15 | 238.4 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 6.72 | -35.85 | 2 | 2 | 1 | 20 | 239.408 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 8.51 | -112.94 | 3 | 2 | 2 | 21 | 240.416 | 5 | ↓ |