In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 18 | Yes |
Popular Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-2-pyrrolidin-1-yl-ethanamine N-[(5-bromo-2-methoxy-phenyl)met…
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) | 2.72 | 7.7 | -112.93 | 3 | 3 | 2 | 30 | 315.255 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.72 | 5.25 | -37.35 | 2 | 3 | 1 | 29 | 314.247 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.72 | 6.32 | -33.13 | 2 | 3 | 1 | 26 | 314.247 | 6 | ↓ |