In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 14 | Yes |
Popular Name: 3-[(4-amino-2,5-dimethyl-pyrazol-3-yl)-methyl-amino]propanenitrile 3-[(4-amino-2,5-dimethyl-pyrazol…
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) | -0.30 | 3.72 | -32.86 | 3 | 5 | 1 | 72 | 194.262 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.30 | 3.61 | -10.32 | 2 | 5 | 0 | 71 | 193.254 | 3 | ↓ |