In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 21 | Yes |
Popular Name: (7R)-N2-ethyl-5,5-dimethyl-N2-phenyl-6,7-dihydro-4H-1,3-benzothiazole-2,7-diamine (7R)-N2-ethyl-5,5-dimethyl-N2-ph…
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) | 2.60 | 8.42 | -44.48 | 3 | 3 | 1 | 44 | 302.467 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 8.09 | -6.36 | 2 | 3 | 0 | 42 | 301.459 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.60 | 8.82 | -94.75 | 4 | 3 | 2 | 45 | 303.475 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.