In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 20 | Yes |
Popular Name: 1,3,5-trimethyl-N-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]pyrazol-4-amine 1,3,5-trimethyl-N-[(1S)-1-(2,4,5…
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) | 3.78 | 8.11 | -6.54 | 1 | 3 | 0 | 30 | 271.408 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.78 | 8.2 | -29.04 | 2 | 3 | 1 | 31 | 272.416 | 3 | ↓ |