In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 21 | Yes |
Popular Name: (7S)-5,5-dimethyl-N-propyl-2-pyrimidin-4-yl-6,7-dihydro-4H-1,3-benzothiazol-7-amine (7S)-5,5-dimethyl-N-propyl-2-pyr…
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) | 3.31 | 7.53 | -41.95 | 2 | 4 | 1 | 55 | 303.455 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.31 | 6.19 | -7.35 | 1 | 4 | 0 | 51 | 302.447 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.