ZINC ID | RADAR | Physiochemical Propperties | Lipophilicity | Water solubility | Phyarmacokinetics | Druglikeness | Medicinal Chemistry |
---|---|---|---|---|---|---|---|
63201776 | Fc1ccc(c(c1)NC(=O)c1c[nH]c(=O)cn1)N | Formula:C11H9FN4O2 Mol: 248.21 Heavy atoms:18 Aromatic heavy atoms: 12 Fraction Csp3: 0.00 Rotatable bonds: 3 H-bond acceptors: 4 H-bond donors: 3 MR: 63.43 TPSA: 100.87 | ILOGP:0.62 XLOGP3: -0.25 WLOGP: 0.98 MLOGP: 0.11 Silicos ITLogP: 1.35 Consensus LogP: 0.56 | ESOL LogS:-1.52 Solubility(mg/ml): 7.550000 Solubility(mol/l):0.030400 Class:Very soluble Ali LogS:-1.41 Solubility(mg/ml): 9.660000 Solubility(mol/l): 0.038900 Class:Very soluble SilicosIT LogS:-4.00 Solubility(mg/ml): 0.024700 Solubility(mol/l): 0.000099 Class:Moderately soluble | GIAbsorption:High BBB permeant: No Pgp substrate: No CYP1A2 inhibitor: No CYP2C19: No CYP2C9: No CYP2D6: No CYP3A4: No Log kp: -7.99 | Lipinski:0 Ghose: 0 Veber: 0 Egan: 0 Muegge: 0 Bioavalability Score0.55 | PAINS:0 Brenk: 1 Leadlikeness: 1 Synthetic Accessibility: 2.20 |