In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 24 | Yes |
Popular Name: 3-[2-(ethylamino)pyrimidine-5-carbonyl]-7-methyl-3,7,10-triazaspiro[5.5]undecan-11-one 3-[2-(ethylamino)pyrimidine-5-ca…
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) | -0.77 | 3.96 | -49.97 | 3 | 8 | 1 | 92 | 333.416 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.77 | 1.79 | -10.83 | 2 | 8 | 0 | 90 | 332.408 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.