In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 17 | Yes |
Popular Name: 6-[[(1R)-1-(5-chloro-2-thienyl)ethyl]amino]-2H-1,2,4-triazine-3,5-dione 6-[[(1R)-1-(5-chloro-2-thienyl)e…
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) | 1.43 | 1.6 | -6.33 | 3 | 6 | 0 | 91 | 272.717 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.89 | -0.07 | -34.54 | 2 | 6 | -1 | 94 | 271.709 | 3 | ↓ |