In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 30 | Yes |
Popular Name: 1-[(2-fluorophenyl)methyl]-3-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]urea 1-[(2-fluorophenyl)methyl]-3-[(3…
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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) | 2.76 | 6.14 | -15.07 | 3 | 6 | 0 | 83 | 402.429 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | 7.02 | -30.8 | 4 | 6 | 1 | 84 | 403.437 | 4 | ↓ |