In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2011 | 21 | No |
Popular Name: N,1-dimethyl-4-nitro-N-(2-piperazin-1-ylethyl)pyrrole-2-carboxamide N,1-dimethyl-4-nitro-N-(2-pipera…
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) | -0.19 | 4.13 | -46.17 | 2 | 8 | 1 | 91 | 296.351 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.19 | 2.78 | -10.61 | 1 | 8 | 0 | 86 | 295.343 | 5 | ↓ |