In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 20 | Yes |
Popular Name: [4-(aminomethyl)phenyl]-(2,3-dihydro-1,4-benzothiazin-4-yl)methanone [4-(aminomethyl)phenyl]-(2,3-dih…
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) | 2.50 | 6.57 | -60.11 | 3 | 3 | 1 | 48 | 285.392 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 6.17 | -9.52 | 2 | 3 | 0 | 46 | 284.384 | 2 | ↓ |