In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2007 | 25 | Yes |
Popular Name: 3-[(cyclopropyl-(4-pyridylmethyl)amino)methyl]-5-(4-fluorophenyl)-1,3,4-oxadiazol-2-one 3-[(cyclopropyl-(4-pyridylmethyl…
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) | 1.98 | 1.16 | -43.68 | 1 | 6 | 1 | 65 | 341.366 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 1.27 | -100.44 | 2 | 6 | 2 | 66 | 342.374 | 6 | ↓ |