In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 21 | No |
Popular Name: 5-chloro-2-[ethyl(4-pyridylmethyl)amino]-N'-hydroxy-benzamidine 5-chloro-2-[ethyl(4-pyridylmethy…
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) | 1.45 | 6.65 | -5.63 | 3 | 5 | 0 | 75 | 304.781 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.45 | 5.36 | -29.45 | 4 | 5 | 1 | 76 | 305.789 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.45 | 7.11 | -36.42 | 4 | 5 | 1 | 76 | 305.789 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.45 | 5.83 | -92.16 | 5 | 5 | 2 | 78 | 306.797 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.