In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 24 | No |
Popular Name: 1-[[2-(dimethylaminomethyl)phenyl]methyl]-5-nitro-indazol-3-ol 1-[[2-(dimethylaminomethyl)pheny…
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) | 2.88 | 7.48 | -56.54 | 1 | 7 | 0 | 91 | 326.356 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 4.94 | -9.84 | 1 | 7 | 0 | 87 | 326.356 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.88 | 6.82 | -44.76 | 2 | 7 | 1 | 88 | 327.364 | 5 | ↓ |