In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 21 | Yes |
Popular Name: (5-ethyl-2-furyl)-(4-methyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl)methanone (5-ethyl-2-furyl)-(4-methyl-3,5-…
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) | 2.74 | 9.61 | -39.35 | 1 | 4 | 1 | 38 | 285.367 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.74 | 7.42 | -8.27 | 0 | 4 | 0 | 37 | 284.359 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.