In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2010 | 22 | Yes |
Popular Name: (1R)-1-(5-chloro-2-thienyl)-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamine (1R)-1-(5-chloro-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) | 3.79 | 7.65 | -53.87 | 2 | 4 | 1 | 44 | 342.868 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.79 | 6.44 | -9.37 | 1 | 4 | 0 | 40 | 341.86 | 7 | ↓ |