In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 19 | No |
Popular Name: 4-[[(2R)-1-ethylpyrrolidin-2-yl]methylamino]-3-fluoro-benzenecarbothioamide 4-[[(2R)-1-ethylpyrrolidin-2-yl]…
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) | 2.48 | 6.84 | -44.88 | 4 | 3 | 1 | 42 | 282.408 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.48 | 4.71 | -10.34 | 3 | 3 | 0 | 41 | 281.4 | 5 | ↓ |