In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 18 | Yes |
Popular Name: (10S)-10-(aminomethyl)-2,3,6,7,8,9-hexahydrocyclohepta[g][1,4]benzodioxin-10-ol (10S)-10-(aminomethyl)-2,3,6,7,8…
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) | 0.91 | 1.71 | -57.14 | 4 | 4 | 1 | 66 | 250.318 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.91 | 1.42 | -8.12 | 3 | 4 | 0 | 65 | 249.31 | 1 | ↓ |