In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 22 | Yes |
Popular Name: 2-[(1R,2S,4aS,6S,8aS)-2-acetyl-2,6,8a-trimethyl-6-vinyl-decalin-1-yl]acetic 2-[(1R,2S,4aS,6S,8aS)-2-acetyl-2…
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) | 3.68 | 9.72 | -57.86 | 0 | 3 | -1 | 57 | 305.438 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.68 | 7.73 | -6.08 | 1 | 3 | 0 | 54 | 306.446 | 4 | ↓ |