In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 16 | Yes |
Popular Name: (1S)-1-(1-methylpyrazol-4-yl)-N,N-dipropyl-ethane-1,2-diamine (1S)-1-(1-methylpyrazol-4-yl)-N,…
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) | 0.86 | 2.49 | -48.25 | 3 | 4 | 1 | 49 | 225.36 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.86 | 4.64 | -117.85 | 4 | 4 | 2 | 50 | 226.368 | 7 | ↓ |