In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 18 | Yes |
Popular Name: N-(2-aminoethyl)-N-methyl-isoquinoline-5-sulfonamide N-(2-aminoethyl)-N-methyl-isoqui…
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) | 0.12 | 0.93 | -53.37 | 3 | 5 | 1 | 78 | 266.346 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.12 | 0.54 | -12.38 | 2 | 5 | 0 | 76 | 265.338 | 4 | ↓ |