In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 17 | Yes |
Popular Name: 4-(2-chlorophenyl)-3-[(1R,2S)-2-methylcyclopropyl]isoxazol-5-amine 4-(2-chlorophenyl)-3-[(1R,2S)-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) | 3.58 | 5.53 | -6.78 | 2 | 3 | 0 | 52 | 248.713 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 5.48 | -24.96 | 3 | 3 | 1 | 53 | 249.721 | 2 | ↓ |