In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2007 | 35 | Yes |
Popular Name: chloro-(4-ethoxy-3-methoxy-phenyl)-methyl-(3-pyridylmethyl)BLAHdione chloro-(4-ethoxy-3-methoxy-pheny…
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) | 4.05 | 2.07 | -12.81 | 0 | 7 | 0 | 81 | 490.943 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.05 | 2.18 | -46.53 | 1 | 7 | 1 | 83 | 491.951 | 6 | ↓ |