In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2004 | 27 | No |
Popular Name: N-cyclohexyl-3-(3-ethoxypropyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide N-cyclohexyl-3-(3-ethoxypropyl)-…
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) | 3.47 | 8.5 | -44.8 | 1 | 6 | -1 | 73 | 388.513 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.81 | 7.5 | -49.36 | 3 | 6 | 1 | 81 | 390.529 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 4.95 | -37.82 | 1 | 6 | -1 | 83 | 388.513 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 8.8 | -13.73 | 2 | 6 | 0 | 76 | 389.521 | 7 | ↓ |