In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 19 | Yes |
Popular Name: (4-amino-1-ethyl-pyrrol-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (4-amino-1-ethyl-pyrrol-2-yl)-[4…
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) | -0.36 | -0.43 | -9.54 | 3 | 6 | 0 | 75 | 266.345 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.36 | 1.86 | -40.47 | 4 | 6 | 1 | 76 | 267.353 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.