In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2007 | 24 | No |
Popular Name: 5-[[2,5-dimethyl-1-(m-tolyl)pyrrol-3-yl]methylene]-2,6-dihydroxy-pyrimidin-4-one 5-[[2,5-dimethyl-1-(m-tolyl)pyrr…
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) | 2.02 | 3.4 | -46.71 | 1 | 6 | -1 | 91 | 322.344 | 2 | ↓ |
Ref Reference (pH 7) | 2.02 | 3.64 | -46.38 | 1 | 6 | -1 | 91 | 322.344 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 3.5 | -46.52 | 1 | 6 | -1 | 91 | 322.344 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 3.5 | -46.96 | 1 | 6 | -1 | 91 | 322.344 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.56 | 6.1 | -9.06 | 2 | 6 | 0 | 88 | 323.352 | 2 | ↓ |