In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 15 | Yes |
Popular Name: 6-[[(1S)-1,3-dimethylbutyl]amino]-2H-1,2,4-triazine-3,5-dione 6-[[(1S)-1,3-dimethylbutyl]amino…
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) | 0.75 | 1.04 | -5.45 | 3 | 6 | 0 | 91 | 212.253 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.21 | -0.63 | -37.06 | 2 | 6 | -1 | 94 | 211.245 | 4 | ↓ |