In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 18 | Yes |
Popular Name: 1,3-dimethyl-5-[methyl-[(1S)-1,2,2-trimethylpropyl]amino]pyrazole-4-carboxylic 1,3-dimethyl-5-[methyl-[(1S)-1,2…
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) | 2.37 | 7.61 | -36.03 | 1 | 5 | 0 | 62 | 253.346 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 7.5 | -49.41 | 0 | 5 | -1 | 61 | 252.338 | 4 | ↓ |