In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 16 | Yes |
Popular Name: (1R)-1-(5-bromo-2-thienyl)-N-[[(3R)-1-methylpyrrolidin-3-yl]methyl]ethanamine (1R)-1-(5-bromo-2-thienyl)-N-[[(…
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) | 3.42 | 6.79 | -35.07 | 2 | 2 | 1 | 16 | 304.277 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 7.95 | -103.83 | 3 | 2 | 2 | 21 | 305.285 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 5.39 | -41.66 | 2 | 2 | 1 | 20 | 304.277 | 4 | ↓ |