In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 21 | Yes |
Popular Name: 4-amino-N-benzyl-N-(2-dimethylaminoethyl)-1H-pyrrole-2-carboxamide 4-amino-N-benzyl-N-(2-dimethylam…
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) | 1.37 | 7.2 | -55.2 | 4 | 5 | 1 | 67 | 287.387 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 6.57 | -108.06 | 4 | 5 | 2 | 65 | 288.395 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.