| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 22nd, 2012 | 32 | No |
Popular Name: Androstane-3,17-diol, 2-(4-morpholinyl)-16-(1-pyrrolidinyl)-, (2¦Â,3¦Á,5¦Á,16¦Â,17¦Â)- Androstane-3,17-diol, 2-(4-morph…
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CAS Number: 119302-20-4
| 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) | 3.36 | 7.14 | -36.2 | 3 | 5 | 1 | 57 | 447.684 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 8.17 | -77.57 | 4 | 5 | 2 | 59 | 448.692 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.