In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 18 | No |
Popular Name: 1-(2-methyl-3-nitro-phenyl)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]methanamine 1-(2-methyl-3-nitro-phenyl)-N-[[…
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) | 2.18 | 6.85 | -52.07 | 2 | 5 | 1 | 72 | 251.306 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.18 | 5.49 | -7.78 | 1 | 5 | 0 | 67 | 250.298 | 5 | ↓ |