| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 13th, 2009 | 32 | Yes |
Popular Name: (2S)-N-(6-aminohexyl)-N-[(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]-2-phenyl-butanamide (2S)-N-(6-aminohexyl)-N-[(1S)-1-…
| 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) | 4.08 | 10.99 | -58.8 | 4 | 6 | 1 | 94 | 435.592 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.53 | 10.77 | -80.39 | 3 | 6 | 0 | 97 | 434.584 | 11 | ↓ |
