In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 15 | Yes |
Popular Name: (1S,2R)-2-methyl-N-[(4-methylthiazol-2-yl)methyl]cyclohexanamine (1S,2R)-2-methyl-N-[(4-methylthi…
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) | 2.53 | 5.91 | -37 | 2 | 2 | 1 | 29 | 225.381 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 4.82 | -3.29 | 1 | 2 | 0 | 25 | 224.373 | 3 | ↓ |