In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 25 | No |
Popular Name: 2-butanoyl-3-[2-[(2R)-2-methyl-2H-indol-3-yl]ethylamino]cyclohex-2-en-1-one 2-butanoyl-3-[2-[(2R)-2-methyl-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) | 3.48 | 9.09 | -8.48 | 1 | 4 | 0 | 62 | 338.451 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.06 | 8.35 | -48.73 | 1 | 4 | -1 | 68 | 337.443 | 5 | ↓ |