In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2007 | 34 | Yes |
Popular Name: chloro-(3,4-dimethoxyphenyl)-methyl-(3-pyridylmethyl)BLAHdione chloro-(3,4-dimethoxyphenyl)-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) | 3.68 | 2.11 | -14.42 | 0 | 7 | 0 | 81 | 476.916 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.68 | 2.22 | -44.07 | 1 | 7 | 1 | 83 | 477.924 | 5 | ↓ |