In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 24 | Yes |
Popular Name: 1,3-benzothiazol-6-yl-(3,7-dimethyl-3,7,10-triazaspiro[5.5]undecan-10-yl)methanone 1,3-benzothiazol-6-yl-(3,7-dimet…
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) | 1.70 | 5.95 | -39.57 | 1 | 5 | 1 | 41 | 345.492 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 8.16 | -109.14 | 2 | 5 | 2 | 42 | 346.5 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.