In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 23 | No |
Popular Name: (3S)-7-chloro-3-(2-methylsulfanylethyl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one (3S)-7-chloro-3-(2-methylsulfany…
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) | 3.28 | 7.69 | -7.88 | 1 | 3 | 0 | 41 | 344.867 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 5.75 | -46.28 | 0 | 3 | -1 | 48 | 343.859 | 4 | ↓ |