In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 12 | Yes |
Popular Name: (2S)-2-[(1-methylpyrazol-4-yl)methylamino]propan-1-ol (2S)-2-[(1-methylpyrazol-4-yl)me…
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) | -0.43 | 0.4 | -38.48 | 3 | 4 | 1 | 55 | 170.236 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.43 | -0.87 | -7.27 | 2 | 4 | 0 | 50 | 169.228 | 4 | ↓ |