In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: 1,3,5-trimethyl-N-[(1R)-1-(2,3,4-trichlorophenyl)ethyl]pyrazol-4-amine 1,3,5-trimethyl-N-[(1R)-1-(2,3,4…
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) | 4.46 | 8.1 | -7.76 | 1 | 3 | 0 | 30 | 332.662 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.46 | 8.22 | -31.24 | 2 | 3 | 1 | 31 | 333.67 | 3 | ↓ |