In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 21 | Yes |
Popular Name: 2-amino-N-(p-tolyl)-N-(3-pyridylmethyl)ethanesulfonamide 2-amino-N-(p-tolyl)-N-(3-pyridyl…
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) | 0.83 | 3.38 | -55.02 | 3 | 5 | 1 | 78 | 306.411 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.83 | 3 | -11.15 | 2 | 5 | 0 | 76 | 305.403 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.83 | 3.82 | -121.74 | 4 | 5 | 2 | 79 | 307.419 | 6 | ↓ |