In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: (1S,2R)-2-[3-(4-methylpiperazin-1-yl)propylcarbamoyl]cyclopropanecarboxylic (1S,2R)-2-[3-(4-methylpiperazin-…
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) | -0.04 | 4.11 | -69.4 | 2 | 6 | 0 | 77 | 269.345 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.04 | 1.74 | -51.74 | 1 | 6 | -1 | 76 | 268.337 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.04 | 4 | -64.86 | 2 | 6 | 0 | 77 | 269.345 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.04 | 2.17 | -46.63 | 3 | 6 | 1 | 74 | 270.353 | 6 | ↓ |