In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 19 | No |
Popular Name: 3-[[(1R)-cyclohex-3-en-1-yl]methyl]-2-thioxo-1H-quinazolin-4-one 3-[[(1R)-cyclohex-3-en-1-yl]meth…
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) | 2.84 | 8.72 | -9.56 | 1 | 3 | 0 | 38 | 272.373 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 8.43 | -39.41 | 0 | 3 | -1 | 35 | 271.365 | 2 | ↓ |