In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: (2S)-N2-cyclopropyl-4-(4-methoxyphenyl)-N2,2-dimethyl-butane-1,2-diamine (2S)-N2-cyclopropyl-4-(4-methoxy…
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) | 2.33 | 4.95 | -47.63 | 3 | 3 | 1 | 40 | 263.405 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 6.36 | -30.8 | 3 | 3 | 1 | 40 | 263.405 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 6.78 | -125.49 | 4 | 3 | 2 | 41 | 264.413 | 7 | ↓ |