In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2006 | 30 | No |
Popular Name: 4-[5-fluoro-2-(2-pyridinyl)-1H-indol-3-yl]-N-{5-nitro-1,3-thiazol-2-yl}butanamide 4-[5-fluoro-2-(2-pyridinyl)-1H-i…
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) | 2.69 | -0.5 | -19.48 | 2 | 8 | 0 | 116 | 425.445 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.69 | -0.32 | -53.21 | 3 | 8 | 1 | 117 | 426.453 | 7 | ↓ |