| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2004 | 34 | No |
Popular Name: 3-[2-(1H-indol-3-yl)ethyl]-4-keto-7-(phenethylcarbamoyl)quinazoline-2-thiolate 3-[2-(1H-indol-3-yl)ethyl]-4-ket…
| 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) | 4.69 | 12.64 | -51.06 | 2 | 6 | -1 | 80 | 467.574 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.97 | 12.88 | -21.83 | 3 | 6 | 0 | 83 | 468.582 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.04 | 10.25 | -16.24 | 3 | 6 | 0 | 86 | 468.582 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.04 | 11.62 | -57.92 | 4 | 6 | 1 | 88 | 469.59 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.49 | 8.99 | -41.86 | 2 | 6 | -1 | 89 | 467.574 | 7 | ↓ |
