In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 4-(aminomethyl)-N-ethyl-2,5-dimethyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]pyrazol-3-amine 4-(aminomethyl)-N-ethyl-2,5-dime…
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) | 0.70 | 4.54 | -42.8 | 3 | 5 | 1 | 58 | 253.37 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 4.14 | -6.91 | 2 | 5 | 0 | 56 | 252.362 | 5 | ↓ |