In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 21 | Yes |
Popular Name: (2S,4aS,8aR)-N-(1,3-benzothiazol-2-ylmethyl)decalin-2-amine (2S,4aS,8aR)-N-(1,3-benzothiazol…
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) | 4.48 | 9.13 | -41.67 | 2 | 2 | 1 | 29 | 301.479 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.48 | 7.96 | -5.36 | 1 | 2 | 0 | 25 | 300.471 | 3 | ↓ |