In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 19 | No |
Popular Name: 1-(4-methyl-3-nitro-phenyl)-N-(2-pyridylmethyl)methanamine 1-(4-methyl-3-nitro-phenyl)-N-(2…
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) | 2.06 | 7.78 | -52.27 | 2 | 5 | 1 | 75 | 258.301 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 6.41 | -9.13 | 1 | 5 | 0 | 71 | 257.293 | 5 | ↓ |