In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (4-bromo-1-methyl-pyrrol-2-yl)-(4-prop-2-ynylpiperazin-1-yl)methanone (4-bromo-1-methyl-pyrrol-2-yl)-(…
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) | 1.39 | 5.27 | -7.95 | 0 | 4 | 0 | 28 | 310.195 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.39 | 7.52 | -43.18 | 1 | 4 | 1 | 30 | 311.203 | 2 | ↓ |