In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 21 | Yes |
Popular Name: (3R)-3-[[(1R,2S,5S)-2-isopropyl-5-methyl-cyclohexyl]amino]indolin-2-one (3R)-3-[[(1R,2S,5S)-2-isopropyl-…
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) | 4.33 | 6.81 | -36.07 | 3 | 3 | 1 | 46 | 287.427 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.33 | 5.75 | -5.23 | 2 | 3 | 0 | 41 | 286.419 | 3 | ↓ |