In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 21 | No |
Popular Name: (1-ethyl-4-nitro-pyrrol-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (1-ethyl-4-nitro-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) | 0.12 | 2.48 | -10.67 | 1 | 8 | 0 | 95 | 296.327 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.12 | 4.77 | -44.62 | 2 | 8 | 1 | 96 | 297.335 | 5 | ↓ |