In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 18 | Yes |
Popular Name: 4-amino-N-[(3,5-dimethylisoxazol-4-yl)methyl]-N-methyl-1H-pyrrole-2-carboxamide 4-amino-N-[(3,5-dimethylisoxazol…
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) | 0.20 | 2.81 | -15.32 | 3 | 6 | 0 | 88 | 248.286 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.25 | 1.54 | -55.33 | 3 | 6 | 1 | 86 | 249.294 | 3 | ↓ |