In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 21 | Yes |
Popular Name: 4-amino-N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-1H-pyrrole-2-carboxamide 4-amino-N-[2-(3,5-dimethylphenox…
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) | 2.45 | 6.38 | -15.91 | 3 | 5 | 0 | 71 | 287.363 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 5.08 | -53.28 | 3 | 5 | 1 | 70 | 288.371 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.