In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 15 | Yes |
Popular Name: (1R,2R)-2-[(5-methylisoxazol-3-yl)methylamino]cyclohexanol (1R,2R)-2-[(5-methylisoxazol-3-y…
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) | 1.20 | 2.17 | -37.67 | 3 | 4 | 1 | 63 | 211.285 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.20 | 0.99 | -7.3 | 2 | 4 | 0 | 58 | 210.277 | 3 | ↓ |