In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: N-[2-fluoro-5-[[(3S)-1-isopropylpyrrolidin-3-yl]amino]phenyl]methanesulfonamide N-[2-fluoro-5-[[(3S)-1-isopropyl…
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) | 2.61 | 3.86 | -45.26 | 3 | 5 | 1 | 63 | 316.422 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 1.6 | -44.37 | 1 | 5 | -1 | 64 | 314.406 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 4.06 | -66.36 | 2 | 5 | 0 | 65 | 315.414 | 5 | ↓ |