In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 19 | Yes |
Popular Name: N-[(5-chloro-1-methyl-imidazol-2-yl)methyl]-3-[(2R)-2-methyl-1-piperidyl]propan-1-amine N-[(5-chloro-1-methyl-imidazol-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) | 2.00 | 7.06 | -35.8 | 2 | 4 | 1 | 34 | 285.843 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 8.43 | -112.34 | 3 | 4 | 2 | 39 | 286.851 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 7.53 | -78.26 | 3 | 4 | 2 | 36 | 286.851 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.00 | 8.88 | -198.89 | 4 | 4 | 3 | 40 | 287.859 | 6 | ↓ |