In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2011 | 30 | Yes |
Popular Name: N-[2-methyl-5-(4-propylpiperazine-1-carbonyl)phenyl]-1,2-benzothiazole-3-carboxamide N-[2-methyl-5-(4-propylpiperazin…
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) | 3.61 | 10.47 | -49.44 | 2 | 6 | 1 | 67 | 423.562 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 8.28 | -15.95 | 1 | 6 | 0 | 66 | 422.554 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.