| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2005 | 35 | Yes |
Popular Name: 1-(3-pyridylmethyl)-3-[4-[[4-(3-pyridylmethylcarbamoylamino)phenyl]methyl]phenyl]-urea 1-(3-pyridylmethyl)-3-[4-[[4-(3-…
| 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) | 3.24 | -6.07 | -18.35 | 4 | 8 | 0 | 108 | 466.545 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | -5.84 | -88.39 | 6 | 8 | 2 | 110 | 468.561 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | -5.95 | -49.88 | 5 | 8 | 1 | 109 | 467.553 | 8 | ↓ |
