In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: 3-methyl-5-(4-methylpiperazin-1-yl)sulfonyl-thiophene-2-carboxylic 3-methyl-5-(4-methylpiperazin-1-…
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) | 1.28 | 2.19 | -46.44 | 0 | 6 | -1 | 81 | 303.385 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.28 | 4.54 | -71.01 | 1 | 6 | 0 | 82 | 304.393 | 3 | ↓ |