In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 24 | Yes |
Popular Name: 5-ethyl-N-[(2R)-4-methyl-2-(4-methylpiperazin-1-yl)pentyl]thiophene-2-sulfonamide 5-ethyl-N-[(2R)-4-methyl-2-(4-me…
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) | 3.31 | 5.28 | -39.71 | 2 | 5 | 1 | 54 | 374.596 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.31 | 2.91 | -8.89 | 1 | 5 | 0 | 53 | 373.588 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 5.14 | -40.21 | 2 | 5 | 1 | 54 | 374.596 | 8 | ↓ |