In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | Yes |
Popular Name: (2R)-2-[[1-(hydroxymethyl)-4-methyl-cyclohexyl]amino]-1-pyrrolidin-1-yl-propan-1-one (2R)-2-[[1-(hydroxymethyl)-4-met…
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) | 1.30 | 4.01 | -33.63 | 3 | 4 | 1 | 57 | 269.409 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.30 | 3.13 | -8.54 | 2 | 4 | 0 | 53 | 268.401 | 4 | ↓ |