In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2010 | 18 | Yes |
Popular Name: (2S)-N-[(4-fluoro-2-methyl-phenyl)methyl]-1-(3-thienyl)propan-2-amine (2S)-N-[(4-fluoro-2-methyl-pheny…
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) | 3.76 | 8.16 | -3.63 | 1 | 1 | 0 | 12 | 263.381 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.76 | 9.2 | -41.5 | 2 | 1 | 1 | 17 | 264.389 | 5 | ↓ |