In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 21 | Yes |
Popular Name: 3-cyclopentylamino-6-[(4-fluorophenyl)methyl]-4H-1,2,4-triazin-5-one 3-cyclopentylamino-6-[(4-fluorop…
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) | 3.54 | 5.98 | -40.03 | 1 | 5 | -1 | 74 | 287.318 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 7.54 | -12.36 | 2 | 5 | 0 | 71 | 288.326 | 4 | ↓ |