In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 16 | Yes |
Popular Name: 3-[[(2R)-3-(4-aminopyrazol-1-yl)-2-hydroxy-propyl]-methyl-amino]propanenitrile 3-[[(2R)-3-(4-aminopyrazol-1-yl)…
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) | -1.36 | -1.41 | -12.62 | 3 | 6 | 0 | 91 | 223.28 | 6 | ↓ |
Mid Mid (pH 6-8) | -1.36 | 1.01 | -54.65 | 4 | 6 | 1 | 92 | 224.288 | 6 | ↓ |