In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 21 | Yes |
Popular Name: (3S)-3-[2-(diisopropylamino)ethylamino]-5-fluoro-indolin-2-one (3S)-3-[2-(diisopropylamino)ethy…
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) | 2.19 | 4.86 | -32.57 | 3 | 4 | 1 | 46 | 294.394 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 4.09 | -42.52 | 3 | 4 | 1 | 49 | 294.394 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 2.79 | -5.99 | 2 | 4 | 0 | 44 | 293.386 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 6.15 | -116.25 | 4 | 4 | 2 | 50 | 295.402 | 6 | ↓ |