In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 21 | No |
Popular Name: 5-chloro-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N'-hydroxy-benzamidine 5-chloro-2-(3,4-dihydro-1H-isoqu…
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) | 2.35 | 6.45 | -5.49 | 3 | 4 | 0 | 62 | 301.777 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.35 | 6.74 | -35.76 | 4 | 4 | 1 | 63 | 302.785 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.