In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 2-[[4-(ethylaminomethyl)-2,5-dimethyl-pyrazol-3-yl]-propyl-amino]ethanol 2-[[4-(ethylaminomethyl)-2,5-dim…
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) | 0.94 | 4.41 | -39.64 | 3 | 5 | 1 | 58 | 255.386 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.94 | 2.92 | -6.6 | 2 | 5 | 0 | 53 | 254.378 | 8 | ↓ |