In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (2S)-N2-cyclopropyl-4-[4-(difluoromethoxy)phenyl]-N2,2-dimethyl-butane-1,2-diamine (2S)-N2-cyclopropyl-4-[4-(difluo…
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) | 2.88 | 5.23 | -47.59 | 3 | 3 | 1 | 40 | 299.385 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 6.64 | -32.39 | 3 | 3 | 1 | 40 | 299.385 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 7.06 | -125.28 | 4 | 3 | 2 | 41 | 300.393 | 8 | ↓ |