In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 21 | Yes |
Popular Name: 4-[(1R)-1-(methylamino)ethyl]-N-(1-methyl-4-piperidyl)benzenesulfonamide 4-[(1R)-1-(methylamino)ethyl]-N-…
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) | 1.54 | 4.37 | -97.51 | 4 | 5 | 2 | 67 | 313.467 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.54 | 4.26 | -78.65 | 3 | 5 | 1 | 69 | 312.459 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.54 | 3.19 | -45.2 | 3 | 5 | 1 | 63 | 312.459 | 5 | ↓ |