In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 19 | Yes |
Popular Name: (1R,2S)-N1-(cyclopropylmethyl)-N1-isopropyl-1-(1-methylpyrazol-4-yl)butane-1,2-diamine (1R,2S)-N1-(cyclopropylmethyl)-N…
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) | 1.59 | 4.21 | -43.62 | 3 | 4 | 1 | 49 | 265.425 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 5.71 | -110.06 | 4 | 4 | 2 | 50 | 266.433 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 5.44 | -32.4 | 3 | 4 | 1 | 48 | 265.425 | 7 | ↓ |