In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 27th, 2007 | 29 | Yes |
Popular Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(3-pyridylmethyl)benzamide 3-(3,4-dihydro-1H-isoquinolin-2-…
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) | 1.97 | -5.67 | -17.25 | 1 | 6 | 0 | 79 | 407.495 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.97 | -5.56 | -51.25 | 2 | 6 | 1 | 80 | 408.503 | 5 | ↓ |