In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 21 | Yes |
Popular Name: N-[(4-imidazol-1-ylphenyl)methyl]-3-isobutoxy-propan-1-amine N-[(4-imidazol-1-ylphenyl)methyl…
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) | 2.21 | 9.93 | -51.6 | 2 | 4 | 1 | 44 | 288.415 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 8.58 | -7.43 | 1 | 4 | 0 | 39 | 287.407 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.21 | 10.45 | -89.12 | 3 | 4 | 2 | 45 | 289.423 | 9 | ↓ |