| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 16 | No |
Popular Name: (5Z)-1-methyl-5-[[(2S)-2H-pyrrol-2-yl]methylene]hexahydropyrimidine-2,4,6-trione (5Z)-1-methyl-5-[[(2S)-2H-pyrrol…
| 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) | -0.54 | -2.84 | -43.04 | 0 | 6 | -1 | 87 | 218.192 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.00 | -0.23 | -8.55 | 1 | 6 | 0 | 84 | 219.2 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.54 | -1.85 | -51.96 | 1 | 6 | 0 | 89 | 219.2 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -1.00 | 0.76 | -40 | 2 | 6 | 1 | 86 | 220.208 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
