In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 21 | Yes |
Popular Name: N-[(2R)-2-cyanopropyl]-N-methyl-3-[(1R)-1-(methylamino)propyl]benzenesulfonamide N-[(2R)-2-cyanopropyl]-N-methyl-…
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) | 1.48 | 5.48 | -52.84 | 2 | 5 | 1 | 78 | 310.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.48 | 4.08 | -12.29 | 1 | 5 | 0 | 73 | 309.435 | 7 | ↓ |