In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 29 | No |
Popular Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-3-(2-ethoxyphenyl)-1-(3-pyridylmethyl)thiourea 1-[(2-chloro-6-fluoro-phenyl)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) | 4.29 | 12.74 | -12.36 | 1 | 4 | 0 | 37 | 429.948 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.29 | 13.38 | -37.8 | 2 | 4 | 1 | 39 | 430.956 | 9 | ↓ |