In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2008 | 19 | Yes |
Popular Name: 3-amino-N-[(4-fluoro-3-methyl-phenyl)methyl]pyrazine-2-carboxamide 3-amino-N-[(4-fluoro-3-methyl-ph…
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) | 1.21 | 2.86 | -7.76 | 3 | 5 | 0 | 81 | 260.272 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 0.73 | -11.18 | 4 | 5 | 0 | 86 | 261.28 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.