In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2008 | 16 | No |
Popular Name: (4aR,11aR)-1,2,3,4,4a,5,8,9,10,11a-decahydrobenzo[b][1,4]benzodiazepin-7-one (4aR,11aR)-1,2,3,4,4a,5,8,9,10,1…
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) | 1.48 | 4.24 | -7.43 | 1 | 3 | 0 | 41 | 218.3 | 0 | ↓ |
Mid Mid (pH 6-8) | 1.81 | -3.39 | -99.36 | 2 | 3 | 2 | 45 | 220.316 | 0 | ↓ |