In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 21 | Yes |
Popular Name: N-methyl-4-oxo-N-(thiazol-4-ylmethyl)-3H-phthalazine-1-carboxamide N-methyl-4-oxo-N-(thiazol-4-ylme…
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) | 1.43 | 3.89 | -9.14 | 1 | 6 | 0 | 79 | 300.343 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 2.1 | -46.71 | 0 | 6 | -1 | 82 | 299.335 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.