In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2010 | 17 | Yes |
Popular Name: 6-methyl-3-[2-[[(2S)-tetrahydrofuran-2-yl]methylamino]ethyl]pyrimidin-4-one 6-methyl-3-[2-[[(2S)-tetrahydrof…
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 | 5.03 | -50.49 | 2 | 5 | 1 | 61 | 238.311 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.22 | 3.61 | -14.5 | 1 | 5 | 0 | 56 | 237.303 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.