In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 18 | Yes |
Popular Name: 4-(4-amino-1H-pyrrole-2-carbonyl)piperazine-1-sulfonamide 4-(4-amino-1H-pyrrole-2-carbonyl…
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) | -1.41 | -3.59 | -15.12 | 5 | 8 | 0 | 126 | 273.318 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.41 | -3.11 | -42.49 | 4 | 8 | -1 | 123 | 272.31 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.85 | -4.71 | -60.14 | 5 | 8 | 1 | 124 | 274.326 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.