In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2008 | 21 | Yes |
Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-1-(m-tolyl)methanesulfonamide N-[2-(4-methylpiperazin-1-yl)eth…
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 | 3.8 | -47.84 | 2 | 5 | 1 | 54 | 312.459 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 1.33 | -12.77 | 1 | 5 | 0 | 53 | 311.451 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 3.27 | -38.11 | 1 | 5 | 0 | 56 | 311.451 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 3.67 | -50.94 | 2 | 5 | 1 | 54 | 312.459 | 6 | ↓ |