In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 23 | Yes |
Popular Name: 2,4-diketo-6-methyl-N-[4-[(1R)-1-methylpropyl]phenyl]-1H-pyrimidine-5-sulfonamide 2,4-diketo-6-methyl-N-[4-[(1R)-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) | 2.09 | 2.48 | -18.32 | 3 | 7 | 0 | 112 | 337.401 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.55 | 1.19 | -101.36 | 1 | 7 | -2 | 117 | 335.385 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.55 | 0.6 | -42.35 | 2 | 7 | -1 | 115 | 336.393 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 3.08 | -49.31 | 2 | 7 | -1 | 114 | 336.393 | 5 | ↓ |