| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 18 | Yes |
Popular Name: 2-[4-[(1S)-1-aminoethyl]phenyl]sulfanyl-6-methyl-1H-pyrimidin-4-one 2-[4-[(1S)-1-aminoethyl]phenyl]s…
| 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) | 0.22 | 4.03 | -57.7 | 4 | 4 | 1 | 73 | 262.358 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.67 | 1.91 | -48.12 | 2 | 4 | -1 | 75 | 260.342 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.67 | 3.17 | -73.34 | 3 | 4 | 0 | 76 | 261.35 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.22 | 3.56 | -58.99 | 4 | 4 | 1 | 73 | 262.358 | 3 | ↓ |
