| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 21 | No |
Popular Name: 3-chloro-N'-hydroxy-4-(9H-purin-6-ylsulfanyl)benzamidine 3-chloro-N'-hydroxy-4-(9H-purin-…
| 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) | 1.00 | 4.54 | -18.26 | 4 | 7 | 0 | 113 | 320.765 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.00 | 4.06 | -43.96 | 3 | 7 | -1 | 111 | 319.757 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
