In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 19 | Yes |
Popular Name: (4R)-8-fluoro-N-(2-pyrrolidin-1-ylethyl)thiochroman-4-amine (4R)-8-fluoro-N-(2-pyrrolidin-1-…
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) | 1.84 | 6.72 | -48.97 | 2 | 2 | 1 | 20 | 281.42 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.84 | 5.9 | -4.58 | 1 | 2 | 0 | 15 | 280.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.84 | 9.08 | -134.29 | 3 | 2 | 2 | 21 | 282.428 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.84 | 8.26 | -42.7 | 2 | 2 | 1 | 16 | 281.42 | 4 | ↓ |