| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 27 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-N-[(1S)-1-phenylethyl]quinazolin-4-amine 2-(4-ethylpiperazin-1-yl)-N-[(1S…
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| 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) | 4.70 | 14.79 | -85.51 | 3 | 5 | 2 | 47 | 363.509 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.70 | 12.27 | -8.46 | 1 | 5 | 0 | 44 | 361.493 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.70 | 14.5 | -38.3 | 2 | 5 | 1 | 45 | 362.501 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.70 | 12.57 | -23.64 | 2 | 5 | 1 | 46 | 362.501 | 5 | ↓ |
