In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 17 | Yes |
Popular Name: (4S)-N-(pyrimidin-4-ylmethyl)-4,5,6,7-tetrahydrobenzofuran-4-amine (4S)-N-(pyrimidin-4-ylmethyl)-4,…
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) | 0.26 | 5.94 | -43.28 | 2 | 4 | 1 | 56 | 230.291 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 4.56 | -8.64 | 1 | 4 | 0 | 51 | 229.283 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.