In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: N3-(2-dimethylaminoethyl)-2,5-dimethyl-N3-propyl-pyrazole-3,4-diamine N3-(2-dimethylaminoethyl)-2,5-di…
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) | 1.15 | 5.91 | -39.97 | 3 | 5 | 1 | 52 | 240.375 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.15 | 3.45 | -4.87 | 2 | 5 | 0 | 50 | 239.367 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.15 | 6.03 | -82.39 | 4 | 5 | 2 | 53 | 241.383 | 6 | ↓ |