In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 33 | Yes |
Popular Name: (3S)-7-chloro-5-(4-methoxyphenyl)-1-methyl-3-(2-naphthylmethyl)-3H-1,4-benzodiazepin-2-one (3S)-7-chloro-5-(4-methoxyphenyl…
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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) | 5.77 | 12.54 | -11.52 | 0 | 4 | 0 | 42 | 454.957 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.77 | 13.29 | -33.42 | 1 | 4 | 1 | 44 | 455.965 | 4 | ↓ |