In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2008 | 30 | Yes |
Popular Name: [2-[(4-hydroxy-6-oxo-5-sec-butyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]BLAHone [2-[(4-hydroxy-6-oxo-5-sec-butyl…
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) | 2.24 | 5.65 | -57.12 | 1 | 8 | -1 | 111 | 429.522 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.24 | 6.08 | -41.94 | 2 | 8 | 0 | 112 | 430.53 | 5 | ↓ |